SCHEMBL1920243

SCHEMBL1920243

N#Cc1cnccc1NC1CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AOC1 P19801 4/20 0.50
PRKCQ Q04759 5/20 0.45
PRKCD Q05655 4/20 0.45
ROCK2 O75116 1/20 0.44
ROCK1 Q13464 1/20 0.44
PTGS1 P23219 6/20 0.43
PTGS2 P35354 5/20 0.43
AOC3 Q16853 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
IRAK4 Q9NWZ3 1/20 0.41
GPR6 P46095 1/20 0.41
CSNK2A1 P68400 1/20 0.40

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
SCHEMBL29580887 0.89 AOC1 (0.41) AOC1PRKCQPRKCDROCK2ROCK1
SCHEMBL1034426 0.89 ROCK2 (0.47) AOC1PRKCQPRKCDROCK2ROCK1
SCHEMBL19520790 0.79 AOC1 (0.57) AOC1PTGS1PTGS2AOC3MEN1
Hydrochloric Acid SCHEMBL3978097 0.76 AOC1 (0.48) AOC1ROCK2ROCK1PTGS1PTGS2
SCHEMBL24074639 0.74 KMT2A (0.47) PRKCQMEN1KMT2A
SCHEMBL30751786 0.74 ROCK2 (0.51) AOC1ROCK2ROCK1AOC3MEN1
SCHEMBL1920863 0.74 ROCK2 (0.51) AOC1ROCK2ROCK1AOC3MEN1
SCHEMBL29539060 0.73 AOC1 (0.54) AOC1ROCK2ROCK1PTGS1PTGS2
SCHEMBL5958407 0.73 AOC1 (0.54) AOC1ROCK2ROCK1PTGS1PTGS2
SCHEMBL30041145 0.72 CHRNB2 (0.36) PRKCQPRKCDIRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3663285-B1 FORMYLPYRIDINE DERIVATIVE HAVING FGFR4 INHIBITORY ACTIVITY, PREPARATION METHOD THEREFOR AND USE THEREOF ABBISKO THERAPEUTICS CO LTD (CN) 2024-01-24 EP disclosed
US-11312701-B2 Formylpyridine derivative having FGFR4 inhibitory activity, preparation method therefor and use thereof ABBISKO THERAPEUTICS CO., LTD (CN) 2022-04-26 US disclosed
EP-2099796-B1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2011-06-01 EP disclosed
EP-2099796-B1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2011-06-01 EP disclosed
US-7855216-B2 Aza-indolyl compounds and methods of use GENENTECH, INC. (US) 2010-12-21 US disclosed
US-7855216-B2 Aza-indolyl compounds and methods of use GENENTECH, INC. (US) 2010-12-21 US disclosed
US-7855216-B2 Aza-indolyl compounds and methods of use GENENTECH, INC. (US) 2010-12-21 US disclosed
EP-2099796-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE Genentech, Inc. (US) 2009-09-16 EP disclosed
US-20080242655-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2008-10-02 US disclosed
US-20080242655-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2008-10-02 US disclosed
US-20080242655-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2008-10-02 US disclosed
WO-2008067481-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2008-06-05 WO disclosed
WO-2008067481-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2008-06-05 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 (2 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-11312701-B2 Formylpyridine derivative having FGFR4 inhibitory activity, preparation method therefor and use thereof FGFR4, FGFR1, FGFR2 AOC1 4467/4885PRKCQ 2418/4885PRKCD 2106/4885
US-20080242655-A1 AZA-INDOLYL COMPOUNDS AND METHODS OF USE CDKN1A, MKI67, CCNI AOC1 1424/4885PRKCQ 541/4885PRKCD 507/4885

“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.