SCHEMBL10698630

SCHEMBL10698630

COCCN1C(=O)C(C)c2cc3c(cc21)NC(c1ccc(O)cc1)N3

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
LMNA P02545 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 1/20 0.34
RECQL P46063 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
TSHR P16473 1/20 0.34
MEN1 O00255 2/20 0.33
GAA P10253 2/20 0.33
AR P10275 1/20 0.33
IDE P14735 1/20 0.33
BRD4 O60885 1/20 0.33
CCL2 P13500 1/20 0.33
HSD17B3 P37058 1/20 0.32
ALDH1A1 P00352 2/20 0.32
OPRM1 P35372 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL10700358 0.89 TNKS2 (0.43) KMT2ALMNASMN1; SMN2MAPTMEN1
SCHEMBL10700676 0.88 ALDH1A1 (0.38) KMT2ALMNASMN1; SMN2MAPTRECQL
SCHEMBL10697745 0.87 KMT2A (0.39) KMT2ASMN1; SMN2MEN1GAAAR
SCHEMBL10697977 0.85 MEN1 (0.36) KMT2ALMNASMN1; SMN2MAPTRECQL
SCHEMBL10696186 0.81 KMT2A (0.43) KMT2ALMNASMN1; SMN2MAPTMEN1
SCHEMBL10699606 0.80 TNKS2 (0.43) KMT2AMAPTMEN1GAABRD4
SCHEMBL10698974 0.78 KMT2A (0.37) KMT2ALMNASMN1; SMN2MAPTRECQL
SCHEMBL10697413 0.78 BMPR1B (0.39) KMT2ALMNASMN1; SMN2MAPTRECQL
SCHEMBL10699249 0.78 HPGD (0.37) KMT2ALMNASMN1; SMN2MAPTRECQL
SCHEMBL10698144 0.77 KDM4E (0.39) TDP1BRD4CCL2ALDH1A1KDM4E

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