SCHEMBL10698461

SCHEMBL10698461

CCN1C(=O)C(C)c2cc3c(cc21)nc(-c1ccc(OC)cc1)n3C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.40
ALDH1A1 P00352 7/20 0.40
LMNA P02545 3/20 0.40
GAA P10253 2/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
USP2 O75604 1/20 0.38
PARP1 P09874 1/20 0.38
F11 P03951 1/20 0.37
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
HTR1A P08908 1/20 0.36
TGM2 P21980 1/20 0.36
TGM1 P22735 1/20 0.36
CASP3 P42574 1/20 0.36
TGM3 Q08188 1/20 0.36
MAPT P10636 4/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL10700264 0.91 ALDH1A1 (0.46) KDM4EALDH1A1LMNAGAATSHR
SCHEMBL10699756 0.88 ALDH1A1 (0.45) KDM4EALDH1A1LMNAGAATSHR
SCHEMBL10698416 0.87 MEN1 (0.37) KDM4EALDH1A1LMNAGAANPSR1
SCHEMBL10695097 0.87 PARP1 (0.40) KDM4EALDH1A1LMNAGAATSHR
SCHEMBL10700981 0.83 MEN1 (0.37) KDM4EALDH1A1LMNAGAANPSR1
SCHEMBL10698855 0.80 CYP11B1 (0.49) MAPTMEN1KMT2ADHFR
SCHEMBL10697536 0.80 MEN1 (0.35) KDM4EALDH1A1HSD17B10SMN1; SMN2MEN1
SCHEMBL10699877 0.79 MEN1 (0.41) KDM4EALDH1A1LMNAGAAHSD17B10
SCHEMBL10699273 0.78 DHODH (0.39) KDM4EALDH1A1GAAHSD17B10NPC1
SCHEMBL10699753 0.78 KDM4E (0.41) KDM4EALDH1A1LMNAGAATSHR

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