SCHEMBL10697571

SCHEMBL10697571

CC1(C)C(=O)N(CCO)c2cc3[nH]c(-c4cccnc4)nc3cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
HPGD P15428 4/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
STAT1 P42224 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD17B10 Q99714 1/20 0.45
AURKA O14965 1/20 0.44
AURKB Q96GD4 1/20 0.44
HTT P42858 1/20 0.43
CYP11B1 P15538 1/20 0.43
LDHA P00338 1/20 0.42
EPHX2 P34913 1/20 0.42
KIT P10721 1/20 0.41
KMT2A Q03164 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40

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
SCHEMBL10695470 0.91 MAPT (0.49) MAPTHPGDALDH1A1KDM4ERAB9A
SCHEMBL10696474 0.90 MAPT (0.47) MAPTHPGDALDH1A1KDM4ERAB9A
SCHEMBL10700213 0.89 AURKA (0.56) MAPTHPGDALDH1A1KDM4ERAB9A
SCHEMBL10698273 0.89 MAPT (0.47) MAPTHPGDALDH1A1KDM4ERAB9A
SCHEMBL10695484 0.89 MAPT (0.47) MAPTHPGDALDH1A1KDM4ERAB9A
SCHEMBL10698598 0.88 PDE4A (0.53) MAPTHPGDALDH1A1KDM4ERAB9A
SCHEMBL10691668 0.86 MAPT (0.54) MAPTHPGDALDH1A1KDM4ERAB9A
SCHEMBL10696409 0.86 HPGD (0.50) MAPTHPGDALDH1A1KDM4ERAB9A
SCHEMBL10699139 0.84 AURKB (0.47) HPGDALDH1A1SMN1; SMN2HSD17B10AURKA
SCHEMBL10532390 0.82 MAPT (0.46) MAPTHPGDALDH1A1KDM4ERAB9A

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