SCHEMBL10698510

SCHEMBL10698510

CC(=O)Nc1ccc2c(c1)C(C)(C)C(=O)N2C(C)C

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
POLB P06746 3/20 0.50
MAPT P10636 2/20 0.50
KDM4A O75164 1/20 0.50
THRB P10828 1/20 0.50
RECQL P46063 1/20 0.50
GLA P06280 1/20 0.48
HSPA9 P38646 4/20 0.44
PGR P06401 1/20 0.42
MAOA P21397 2/20 0.42
ALDH1A1 P00352 3/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TP53 P04637 2/20 0.40
HSD17B10 Q99714 1/20 0.40
MYC P01106 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
SCHEMBL4512009 0.83 MEN1 (0.44) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL2492094 0.82 MAPT (0.57) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10882762 0.79 MEN1 (0.48) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10708746 0.78 MAPT (0.50) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10883259 0.78 POLB (0.47) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10695610 0.76 MAPT (0.51) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10883793 0.75 SMN1; SMN2 (0.44) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL5541399 0.75 MEN1 (0.49) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL10695502 0.74 MAPT (0.49) MEN1KMT2ASMN1; SMN2POLBMAPT
SCHEMBL5010350 0.74 ALDH1A1 (0.39) MEN1KMT2ASMN1; SMN2GLAHSPA9

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