SCHEMBL676505

SCHEMBL676505

NC(=O)c1ccc2[nH]c3ncccc3c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.50
CAMKK2 Q96RR4 1/20 0.50
MAP2K7 O14733 1/20 0.47
CHEK1 O14757 1/20 0.47
MAPKAPK2 P49137 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PARP1 P09874 2/20 0.44
AURKA O14965 1/20 0.44
ERBB2 P04626 2/20 0.43
PTK6 Q13882 1/20 0.43
GSK3A P49840 1/20 0.43
GSK3B P49841 1/20 0.43
CDK5 Q00535 1/20 0.43
CDK5R1 Q15078 1/20 0.43
PRKCI P41743 1/20 0.42
MAPT P10636 2/20 0.42
HTR1B P28222 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL3893133 0.88 RIPK1 (0.50) RIPK1CAMKK2CHEK1MEN1KMT2A
SCHEMBL676547 0.87 GSK3B (0.55) CAMKK2CHEK1MEN1KMT2APARP1
SCHEMBL675383 0.85 ERBB2 (0.55) CHEK1MEN1KMT2APARP1AURKA
SCHEMBL5436301 0.83 KIF11 (0.56) MEN1KMT2APARP1GSK3BMAPT
SCHEMBL677456 0.83 ALK (0.47) CHEK1MEN1KMT2APARP1AURKA
SCHEMBL675148 0.82 MEN1 (0.44) CHEK1MEN1KMT2APARP1AURKA
SCHEMBL676206 0.81 MEN1 (0.46) CHEK1MEN1KMT2APARP1AURKA
SCHEMBL30561448 0.81 PARP1 (0.46) RIPK1CAMKK2MAP2K7MAPKAPK2MEN1
SCHEMBL677968 0.80 MAPT (0.46) RIPK1CHEK1MEN1KMT2APARP1
SCHEMBL678627 0.80 CYP1A2 (0.50) CHEK1MEN1KMT2APARP1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3802534-B1 TRICYCLIC HETEROCYCLIC COMPOUNDS AS STING ACTIVATORS INCYTE CORP (US) 2022-07-13 EP claimed
US-8895744-B2 Alfa-carboline inhibitors of NPM-ALK, RET, and Bcr-Abl UNIVERSITA' DEGLI STUDI DI MILANO-BICOCCA (IT) 2014-11-25 US disclosed
US-20110281862-A1 ALFA-CARBOLINE INHIBITORS OF NPM-ALK, RET, AND BCR-ABL UNIVERSITA' DEGLI STUDI DI MILANO - BICOCCA (IT) 2011-11-17 US disclosed
EP-2161271-A1 Alpha-carboline inhibitors of NMP-ALK, RET, and Bcr-Abl Università Degli Studi Di Milano - Bicocca (IT) 2010-03-10 EP disclosed
EP-1940840-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2008-07-09 EP disclosed
WO-2007045758-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-04-26 WO 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 (1 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-20110281862-A1 ALFA-CARBOLINE INHIBITORS OF NPM-ALK, RET, AND BCR-ABL ALK, BCR, NPM1 RIPK1 1355/4885CAMKK2 1757/4885MAP2K7 2567/4885

“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.