SCHEMBL6311629

SCHEMBL6311629

CCOC(=O)Cc1csc(-c2ccccc2)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.66
LMNA P02545 2/20 0.59
TP53 P04637 2/20 0.59
KDM4E B2RXH2 2/20 0.59
TRPM8 Q7Z2W7 1/20 0.59
ALDH1A1 P00352 3/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
HSD17B10 Q99714 2/20 0.56
PKM P14618 1/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
HPGD P15428 1/20 0.54

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
SCHEMBL21560172 0.91 MAPT (0.57) MAPTLMNATP53TRPM8ALDH1A1
SCHEMBL3374076 0.89 MEN1 (0.57) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL31578670 0.87 ALDH1A1 (0.60) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL8847666 0.87 MAPT (0.53) MAPTLMNATP53KDM4ETRPM8
SCHEMBL2073208 0.86 MAPT (0.65) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL3371234 0.86 RAB9A (0.54) MAPTLMNATP53KDM4ETRPM8
SCHEMBL11157975 0.86 MEN1 (0.62) MAPTLMNAKDM4EALDH1A1MEN1
SCHEMBL4907597 0.86 LMNA (0.67) MAPTLMNATP53KDM4ETRPM8
SCHEMBL20241864 0.86 SHMT1 (0.64) MAPTLMNATP53KDM4EALDH1A1
SCHEMBL11164179 0.86 MEN1 (0.60) MAPTLMNATP53KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11091451-B2 SHMT inhibitors and uses thereof RAZE THERAPEUTICS, INC. (US) 2021-08-17 US disclosed
US-20190345119-A1 SHMT INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2019-11-14 US disclosed
WO-2015172196-A1 HETEROCYCLIC COMPOUNDS AND USE OF SAME MONASH UNIVERSITY (AU) 2015-11-19 WO disclosed
WO-2015172196-A1 HETEROCYCLIC COMPOUNDS AND USE OF SAME MONASH UNIVERSITY (AU) 2015-11-19 WO disclosed
CN-1633434-A Imidazo [1, 2-a ] pyridine derivatives DAIICHI SEIYAKU CO (JP) 2005-06-29 CN disclosed
US-20050113397-A1 Imidazo[1,2-a]pyridine derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-05-26 US disclosed
EP-1501830-A1 7-ARYL-3,9-DIAZABICYCLO[3.3.1]NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES Actelion Pharmaceuticals Ltd. (CH) 2005-02-02 EP disclosed
EP-1479681-A1 IMIDAZO(1,2-a)PYRIDINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-11-24 EP disclosed
WO-2003093267-A1 7-ARYL-3,9-DIAZABICYCLO(3.3.1)NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES ACTELION PHARMACEUTICALS LTD (CH) 2003-11-13 WO disclosed
US-20030171588-A1 1,2-disubstituted-6-oxo-3-phenyl-piperidine-3-carboxamides and combinatorial libraries thereof LION BIOSCIENCE AG (DE) 2003-09-11 US disclosed
US-4683227-A CEPHALOSPORINS ELI LILLY AND COMPANY (US) 1987-07-28 US disclosed
EP-0211526-A2 Cephalosporins, their preparation and formulations ELI LILLY AND COMPANY (US) 1987-02-25 EP 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 (4 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-20030171588-A1 1,2-disubstituted-6-oxo-3-phenyl-piperidine-3-carboxamides and combinatorial libraries thereof BRD4, BICRA, HDAC6 MAPT 1410/4885LMNA 3593/4885TP53 4615/4885
US-11091451-B2 SHMT inhibitors and uses thereof SHMT1, SHMT2, BHMT MAPT 1852/4885LMNA 4283/4885TP53 506/4885
US-20190345119-A1 SHMT INHIBITORS AND USES THEREOF SHMT1, SHMT2, BHMT MAPT 1852/4885LMNA 4283/4885TP53 506/4885
US-20050113397-A1 Imidazo[1,2-a]pyridine derivative MANBA, MAN2B1, ERG28 MAPT 1694/4885LMNA 3993/4885TP53 3018/4885

“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.