SCHEMBL5553141

SCHEMBL5553141

c1ccc(-c2cn3c4c(sc3n2)CCCC4)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 10/20 0.97
RAB9A P51151 9/20 0.97
NPC1 O15118 8/20 0.97
TP53 P04637 8/20 0.97
MAPT P10636 7/20 0.97
ALDH1A1 P00352 6/20 0.97
TSHR P16473 5/20 0.97
PKM P14618 2/20 0.97
KMT2A Q03164 1/20 0.97
HDAC6 Q9UBN7 1/20 0.75
NFKB1 P19838 2/20 0.70
NFKB2 Q00653 2/20 0.70
RELA Q04206 2/20 0.70
GAA P10253 1/20 0.70
GFER P55789 1/20 0.70
LMNA P02545 5/20 0.45
HTT P42858 2/20 0.45
USP2 O75604 1/20 0.45
ATM Q13315 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Dimethylamine SCHEMBL8559714 0.95 SMN1; SMN2 (0.87) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL5553186 0.86 HDAC6 (0.76) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL3627340 0.86 HDAC6 (1.00) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL13650865 0.86 HDAC6 (0.76) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL13650905 0.84 MAPT (0.70) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL13650862 0.83 MAPT (0.67) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL8407047 0.82 HDAC6 (0.74) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL12692391 0.82 RAB9A (1.00) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL5550021 0.82 HDAC6 (0.70) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL11358930 0.81 RAB9A (0.66) SMN1; SMN2RAB9ANPC1TP53MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1143943-B1 USE OF p53 INHIBITORS FOR THE TREATMENT OF SIDE EFFECTS OF CANCER THERAPY UNIV ILLINOIS (US) 2007-12-12 EP claimed
EP-1797880-A2 Use of P53 inhibitors for the treatment of side effects of cancer therapy BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-06-20 EP claimed
US-20050222224-A1 p53 Inhibitors and therapeutic use of the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2005-10-06 US claimed
US-20030176318-A1 p53 inhibitors and therapeutic use of the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2003-09-18 US claimed
US-20030144331-A1 p53 inhibitors and therapeutic use of the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2003-07-31 US claimed
US-20020019425-A1 p53 Inhibitors and therapeutic use of the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2002-02-14 US claimed
US-20020006941-A1 p53 inhibitors and therapeutic use of the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2002-01-17 US claimed
US-10028992-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2018-07-24 US disclosed
US-10028992-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2018-07-24 US disclosed
US-20150290276-A1 METHODS OF TREATING MUSCULAR DYSTROPHY BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION, ON BEHALF OF THE UNIVERSITY 2015-10-15 US disclosed
US-20150290276-A1 METHODS OF TREATING MUSCULAR DYSTROPHY BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION, ON BEHALF OF THE UNIVERSITY 2015-10-15 US disclosed
US-20090011975-A1 TARGETED BONE MARROW PROTECTION AGENTS SEMAFORE PHARMACEUTICALS INC. (US) 2009-01-08 US disclosed
EP-1143943-B1 USE OF p53 INHIBITORS FOR THE TREATMENT OF SIDE EFFECTS OF CANCER THERAPY UNIV ILLINOIS (US) 2007-12-12 EP disclosed
EP-1797880-A2 Use of P53 inhibitors for the treatment of side effects of cancer therapy BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-06-20 EP disclosed
US-20020019425-A1 p53 Inhibitors and therapeutic use of the same THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2002-02-14 US disclosed
US-5919799-A OVERCOMING RESISTANCE TO AN ANTI-NEOPLASTIC AGENT OR AN ENHANCER FOR THE EFFECT OF AN ANTI-NEOPLASTIC AGENT COMPRISING SAID ENHANCER FOR THE EFFECT OF AN ANTI-NEOPLASTIC AGENT NIKKEN CHEMICALS CO., LTD. (JP) 1999-07-06 US disclosed
EP-0816366-A1 IMIDAZOTHIAZOLE COMPOUNDS Nikken Chemicals Company, Limited (JP) 1998-01-07 EP disclosed
US-4419289-A YELLOW COLOR FOR POLYESTERS, POLYAMIDES, AND CELLULOSE ESTERS EASTMAN KODAK COMPANY (US) 1983-12-06 US disclosed
US-4396547-A INDOLE, THIADIAZOLE AND MONOAZO DYES EASTMAN KODAK COMPANY (US) 1983-08-02 US disclosed
US-4354970-A YELLOW TEXTILE DYE EASTMAN KODAK COMPANY (US) 1982-10-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150290276-A1 METHODS OF TREATING MUSCULAR DYSTROPHY ITGB7, ITGA2B, ITGB1 SMN1; SMN2 22/4885RAB9A 1131/4885NPC1 2830/4885
US-20090011975-A1 TARGETED BONE MARROW PROTECTION AGENTS APAF1, BST2, MCL1 SMN1; SMN2 1734/4885RAB9A 3244/4885NPC1 2543/4885
US-10028992-B2 Methods of treating muscular dystrophy ITGB7, ITGA2B, ITGB1 SMN1; SMN2 22/4885RAB9A 1131/4885NPC1 2830/4885
US-20020006941-A1 p53 inhibitors and therapeutic use of the same TP53, TP53BP1, CDKN1A SMN1; SMN2 3213/4885RAB9A 3270/4885NPC1 2878/4885
US-20050222224-A1 p53 Inhibitors and therapeutic use of the same TP53, TP53BP1, CDKN1A SMN1; SMN2 3213/4885RAB9A 3270/4885NPC1 2878/4885
US-20030144331-A1 p53 inhibitors and therapeutic use of the same TP53, TP53BP1, CDKN1A SMN1; SMN2 3213/4885RAB9A 3270/4885NPC1 2878/4885
US-20030176318-A1 p53 inhibitors and therapeutic use of the same TP53, TP53BP1, CDKN1A SMN1; SMN2 3213/4885RAB9A 3270/4885NPC1 2878/4885
US-20020019425-A1 p53 Inhibitors and therapeutic use of the same TP53, TP53BP1, CDKN1A SMN1; SMN2 3213/4885RAB9A 3270/4885NPC1 2878/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.