SCHEMBL23656272

SCHEMBL23656272

C=Nc1ccc(N)cc1/C=C\C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL24734749 0.85 LMNA (0.32) ALDH1A1
SCHEMBL18024071 0.79 KDM4E (0.36) ALDH1A1
SCHEMBL20274086 0.78 ERN1 (0.32) ALDH1A1
SCHEMBL19337459 0.78 F2RL1 (0.38)
SCHEMBL20274081 0.78 ERN1 (0.32) ALDH1A1
SCHEMBL19941250 0.77 ALOX5 (0.32)
SCHEMBL22917369 0.76 ALDH1A1 (0.34) ALDH1A1
SCHEMBL25481760 0.75 TYR (0.35) ALDH1A1
SCHEMBL9928484 0.75 MAPT (0.40) ALDH1A1
SCHEMBL454407 0.74 CASP1 (0.39) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3984534-A1 DIARYLAMIDE COMPOUND AND APPLICATION THEREOF Peking University (CN) 2022-04-20 EP disclosed
EP-3851443-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2021-07-21 EP disclosed