SCHEMBL20909693

SCHEMBL20909693

Cc1ccc2nc(N(C)C)[nH]c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.59
▸ POLB P06746 1/20 0.59
▸ ALDH1A1 P00352 3/20 0.53
▸ HPGD P15428 2/20 0.53
▸ USP2 O75604 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ CYP1A2 P05177 1/20 0.51
▸ PIN1 Q13526 1/20 0.51
▸ NPC1 O15118 5/20 0.50
▸ RAB9A P51151 5/20 0.50
▸ GAA P10253 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ KDM4E B2RXH2 3/20 0.47
▸ ADORA2A P29274 1/20 0.47
▸ GFER P55789 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ METAP2 P50579 2/20 0.46
▸ METAP1 P53582 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46

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
SCHEMBL20677806 0.87 KMT2A (0.56) KMT2APOLBALDH1A1HPGDUSP2
SCHEMBL11436852 0.80 PIN1 (0.59) KMT2APOLBALDH1A1HPGDUSP2
SCHEMBL29258829 0.80 TCF4 (0.59) METAP2METAP1CBFB
SCHEMBL481951 0.80 ALDH1A1 (0.56) ALDH1A1HTTRAB9AKDM4EMAPT
SCHEMBL1663444 0.80 MEN1 (0.54) KMT2APOLBALDH1A1HPGDUSP2
SCHEMBL20883960 0.77 SCN10A (0.52) KMT2APOLBCYP1A2NPC1RAB9A
SCHEMBL20884005 0.77 MCHR1 (0.46) KMT2APOLBALDH1A1CYP1A2NPC1
SCHEMBL266609 0.76 ALDH1A1 (0.66) KMT2APOLBALDH1A1HPGDUSP2
SCHEMBL29727934 0.76 ALDH1A1 (0.66) KMT2APOLBALDH1A1HPGDUSP2
SCHEMBL358399 0.75 LMNA (0.62) KMT2APOLBALDH1A1HPGDCYP1A2

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
WO-2019074979-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF GIRAFPHARMA, LLC (US) 2019-04-18 — — WO disclosed
Send feedback