SCHEMBL10697223

SCHEMBL10697223

CCN1C(=O)C(C)(C)c2cc3c(cc21)N(C)C(c1ccc(OC)cc1)N3

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
OPRM1 P35372 1/20 0.37
OPRL1 P41146 1/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KDM4E B2RXH2 5/20 0.37
ALDH1A1 P00352 5/20 0.37
HPGD P15428 3/20 0.37
GLA P06280 1/20 0.37
HIF1A Q16665 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
THRB P10828 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
ABCB1 P08183 4/20 0.36
NPSR1 Q6W5P4 1/20 0.35
AURKA O14965 1/20 0.35
AURKB Q96GD4 1/20 0.35
ALOX12 P18054 1/20 0.34

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
SCHEMBL10697525 0.90 MEN1 (0.36) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL10699610 0.90 MEN1 (0.36) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL10697809 0.87 CNR1 (0.39) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL10699175 0.87 AURKA (0.38) KMT2AGAAKDM4EALDH1A1HPGD
SCHEMBL10701198 0.84 TNKS2 (0.44) MEN1KMT2AOPRM1OPRL1GAA
SCHEMBL10699079 0.79 HTT (0.39) MEN1KMT2AGAAKDM4EALDH1A1
SCHEMBL10698676 0.78 KDM4E (0.35) L3MBTL1KDM4EALDH1A1HPGDTDP1
SCHEMBL10700743 0.77 MEN1 (0.33) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL10698674 0.77 KDM4E (0.34) KDM4EALDH1A1HPGDTDP1
SCHEMBL10695087 0.75 TNKS2 (0.44) MEN1KMT2AGAAL3MBTL1KDM4E

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-0268178-A1 Pyrrolo-benzimidazoles, medicaments containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1988-05-25 EP disclosed