SCHEMBL24987471

SCHEMBL24987471

CNC(=O)c1cnn2c(N(C)Cc3ccc(OC)cc3)cc(Nc3cccc(C)n3)nc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.46
▸ PDE2A O00408 3/20 0.42
▸ ALDH1A1 P00352 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ HTT P42858 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ CYP1A1 P04798 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TYK2 P29597 5/20 0.38
▸ HSD17B10 Q99714 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ GBA1 P04062 1/20 0.37
▸ TSHR P16473 1/20 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
SCHEMBL22092692 0.93 POLB (0.44) POLBPDE2AALDH1A1KDM4EHPGD
SCHEMBL22092637 0.89 KDM4E (0.41) POLBPDE2AALDH1A1KDM4EHPGD
SCHEMBL24985048 0.86 NPC1 (0.37) POLBALDH1A1NPSR1TDP1L3MBTL1
SCHEMBL22092671 0.85 TYK2 (0.56) POLBTYK2STAT3
SCHEMBL21811164 0.78 AKR1C3 (0.46) POLBALDH1A1KDM4EHTTNPSR1
SCHEMBL21887372 0.78 TDP1 (0.44) POLBPDE2AALDH1A1KDM4EHTT
SCHEMBL21887375 0.76 KDM4E (0.42) POLBPDE2AALDH1A1KDM4EHPGD
SCHEMBL21887777 0.76 MAPT (0.44) POLBALDH1A1KDM4EHPGDHTT
SCHEMBL22103738 0.76 TYK2 (0.58) TYK2STAT3
SCHEMBL21887378 0.75 KCNH2 (0.44) POLBALDH1A1KDM4EHTTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3894412-B1 7-(METHYLAMINO)PYRAZOLO[1,5-A]PYRIMIDINE-3-CARBOXAMIDE DERIVATIVES LILLY CO ELI (US) 2023-02-08 — — EP disclosed
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