SCHEMBL16332667

SCHEMBL16332667

CNc1nc2cnc(Nc3ccc(OC)c(OC)c3)cc2n1Cc1ccco1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.42
▸ SHMT2 P34897 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ IGF1R P08069 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ TSHR P16473 2/20 0.41
▸ MAPT P10636 4/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ RXFP1 Q9HBX9 2/20 0.39
▸ CSF1R P07333 2/20 0.38
▸ KIT P10721 2/20 0.38
▸ PKM P14618 1/20 0.38
▸ TRPC5 Q9UL62 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.37
▸ CDK4 P11802 1/20 0.37
▸ CCND1 P24385 1/20 0.37
▸ CCND2 P30279 1/20 0.37
▸ CCND3 P30281 1/20 0.37
▸ HPGD P15428 2/20 0.37

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
SCHEMBL16331809 0.91 IGF1R (0.42) IGF1RALDH1A1MAPTLMNAMAPK1
SCHEMBL16331731 0.89 TRPC5 (0.47) TP53RAB9AIGF1RALDH1A1TSHR
SCHEMBL16331960 0.86 CSF1R (0.46) TP53RAB9AIGF1RALDH1A1TSHR
SCHEMBL16331429 0.83 ALDH1A1 (0.42) TP53RAB9AALDH1A1TSHRMAPT
SCHEMBL16332829 0.81 TRPC5 (0.40) SHMT2RAB9AALDH1A1MAPTLMNA
SCHEMBL16332347 0.81 EGFR (0.44) TP53SHMT2IGF1RTSHRMAPT
SCHEMBL16332751 0.80 IGF1R (0.44) IGF1RALDH1A1MAPTPKMHPGD
SCHEMBL16332134 0.80 SMN1; SMN2 (0.52) TP53RAB9AALDH1A1TSHRMAPT
SCHEMBL16332223 0.79 SMN1; SMN2 (0.44) IGF1RALDH1A1TSHRLMNAMAPK1
SCHEMBL16332395 0.79 LMNA (0.47) TP53ALDH1A1TSHRMAPTLMNA

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-2818472-A1 Imidazo[4,5-c]pyridine and pyrrolo[3,2-c]pyridine compounds as G-protein-coupled receptor kinase 5 (GRK5) modulators Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2014-12-31 — — EP claimed
EP-2818472-A1 Imidazo[4,5-c]pyridine and pyrrolo[3,2-c]pyridine compounds as G-protein-coupled receptor kinase 5 (GRK5) modulators Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2014-12-31 — — EP disclosed
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