SCHEMBL30170765

SCHEMBL30170765

COc1ccc(COc2ccc(C#N)cc2OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 3/20 0.55
▸ CSF1R P07333 7/20 0.52
▸ NTRK1 P04629 1/20 0.48
▸ NTRK3 Q16288 1/20 0.48
▸ NTRK2 Q16620 1/20 0.48
▸ MAOB P27338 3/20 0.48
▸ MAOA P21397 1/20 0.48
▸ APP P05067 3/20 0.47
▸ KIT P10721 3/20 0.47

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
SCHEMBL524596 1.00 AR (0.55) ARCSF1RNTRK1NTRK3NTRK2
SCHEMBL3490042 0.87 MAOB (0.57) ARMAOB
SCHEMBL23949942 0.86 MAOB (0.46) ARMAOBMAOAAPP
SCHEMBL8156292 0.86 APP (0.53) ARCSF1RMAOBMAOAAPP
SCHEMBL23882866 0.86 APP (0.53) ARCSF1RMAOBMAOAAPP
SCHEMBL7145572 0.82 CA12 (0.61) CSF1RNTRK1NTRK3NTRK2MAOB
SCHEMBL2276512 0.82 MAOB (0.68) MAOBMAOAAPP
SCHEMBL28838736 0.82 MRGPRX4 (0.57) ARMAOBMAOAAPP
SCHEMBL7378373 0.82 TUBB1 (0.48) CSF1RMAOBMAOAAPP
SCHEMBL23235862 0.82 AR (0.55) ARCSF1R

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
CN-115697989-A Tropomyosin Receptor Kinase (TRK) degrading compounds and methods of use 上海睿跃生物科技有限公司 2023-02-03 — — CN disclosed
EP-4110772-A1 TROPOMYOSIN RECEPTOR KINASE (TRK) DEGRADATION COMPOUNDS AND METHODS OF USE Cullgen (Shanghai), Inc. (CN) 2023-01-04 — — EP disclosed
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