SCHEMBL6284121

SCHEMBL6284121

NC(=O)[C@@H]1CCN(Cc2ccccc2)C1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.63
S1PR5 Q9H228 2/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
LTA4H P09960 1/20 0.60
SCN4A P35499 2/20 0.59
MEN1 O00255 1/20 0.58
TSHR P16473 1/20 0.58
KMT2A Q03164 1/20 0.58
KDM4E B2RXH2 2/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 1/20 0.56
S1PR1 P21453 1/20 0.55
ABL1 P00519 1/20 0.55
RIN1 Q13671 1/20 0.55

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
SCHEMBL2450749 1.00 GAA (0.63) GAAS1PR5NPC1RAB9ALTA4H
SCHEMBL6286609 1.00 GAA (0.63) GAAS1PR5NPC1RAB9ALTA4H
SCHEMBL3157551 0.91 GAA (0.61) GAAS1PR5NPC1RAB9ALTA4H
SCHEMBL2444402 0.91 GAA (0.77) GAANPC1RAB9ALTA4HMEN1
SCHEMBL3314498 0.91 GAA (0.77) GAANPC1RAB9ALTA4HMEN1
SCHEMBL518686 0.90 NPC1 (0.71) GAANPC1RAB9AMEN1TSHR
SCHEMBL8318203 0.90 GAA (0.58) GAAS1PR5NPC1RAB9ASCN4A
Hydrochloric Acid SCHEMBL8324757 0.89 GAA (0.57) GAAS1PR5NPC1RAB9ASCN4A
Hydrochloric Acid SCHEMBL5712502 0.89 NPC1 (0.70) GAANPC1RAB9AMEN1TSHR
SCHEMBL9037650 0.87 S1PR5 (0.77) S1PR5LTA4HSCN4AMEN1TSHR

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12071436-B2 Anti-parasitic compounds and uses thereof UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-08-27 US disclosed
US-20220340557-A1 ANTI-PARASITIC COMPOUNDS AND USES THEREOF MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2022-10-27 US disclosed
US-11180492-B2 Anti-parasitic compounds and uses thereof UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2021-11-23 US disclosed
US-20190002463-A1 ANTI-PARASITIC COMPOUNDS AND USES THEREOF MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2019-01-03 US disclosed
WO-2017124087-A1 ANTI-PARASITIC COMPOUNDS AND USES THEREOF MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2017-07-20 WO disclosed
WO-2009102325-A1 IMIDAZOLYL BIPHENYL IMIDAZOLES AS HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-20 WO disclosed
WO-2008021927-A2 HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-02-21 WO disclosed
US-20050171183-A1 Indole-type inhibitors of p38 kinase SCIOS, INC. (US) 2005-08-04 US disclosed
US-6890938-B2 Indole-type inhibitors of p38 kinase SCIOS, INC. (US) 2005-05-10 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 (5 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-11180492-B2 Anti-parasitic compounds and uses thereof MPO, GOT2, GOT1 GAA 17/4885S1PR5 553/4885NPC1 539/4885
US-12071436-B2 Anti-parasitic compounds and uses thereof MPO, GOT2, GOT1 GAA 17/4885S1PR5 553/4885NPC1 539/4885
US-20220340557-A1 ANTI-PARASITIC COMPOUNDS AND USES THEREOF MPO, GOT2, GOT1 GAA 17/4885S1PR5 553/4885NPC1 539/4885
US-20190002463-A1 ANTI-PARASITIC COMPOUNDS AND USES THEREOF MPO, GOT2, GOT1 GAA 17/4885S1PR5 553/4885NPC1 539/4885
US-20050171183-A1 Indole-type inhibitors of p38 kinase MAPK1, MAPKAPK2, MAP3K1 GAA 4527/4885S1PR5 2021/4885NPC1 2213/4885

“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.