SCHEMBL11527538

SCHEMBL11527538

COc1ccc2c3c(ccc(OC)c13)C(=O)N(NC(C)C)C2=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 1/20 0.42
▸ RAB9A P51151 4/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KMT2A Q03164 6/20 0.41
▸ POLB P06746 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ LMNA P02545 1/20 0.41
▸ PABPC1 P11940 1/20 0.41
▸ XBP1 P17861 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMARCA2 P51531 1/20 0.41
▸ NFKB2 Q00653 1/20 0.41
▸ RELA Q04206 1/20 0.41
▸ CYP19A1 P11511 1/20 0.37
▸ NQO2 P16083 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37

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
SCHEMBL11531210 0.88 NPC1 (0.42) PRMT1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL11530531 0.81 PRMT1 (0.45) PRMT1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL11529213 0.80 PRMT1 (0.39) PRMT1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL11531118 0.77 L3MBTL1 (0.43) RAB9ANPC1L3MBTL1KMT2APOLB
SCHEMBL11040911 0.75 PRMT1 (0.67) PRMT1L3MBTL1KMT2APOLBKDM4E
SCHEMBL20735081 0.73 RAB9A (0.56) PRMT1RAB9AKMT2APOLBKDM4E
SCHEMBL5376386 0.72 KDM4E (0.41) PRMT1KMT2APOLBKDM4EALDH1A1
SCHEMBL14256476 0.71 CYP1A2 (0.50) RAB9AL3MBTL1KMT2AKDM4EALDH1A1
SCHEMBL12940963 0.70 MAPT (0.48) PRMT1RAB9ANPC1KMT2APOLB
SCHEMBL5014222 0.70 ANPEP (0.55) PRMT1KMT2APOLBKDM4EALDH1A1

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
US-4139532-A OPTICAL BRIGHTENERS FOR POLYESTERS AND THEIR BLENDS WITH COTTON BASF AKTIENGESELLSCHAFT (DE) 1979-02-13 — — US disclosed
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