SCHEMBL17692571

SCHEMBL17692571

CNC(=O)c1cc(-c2ccc(C(=O)O)c(C(=O)NC(C)COCC(C)C)c2)ccc1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 3/20 0.38
▸ SLC22A12 Q96S37 1/20 0.38
▸ ADRB3 P13945 3/20 0.38
▸ ADRB1 P08588 2/20 0.38
▸ BRD4 O60885 1/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ CFD P00746 1/20 0.34
▸ ACLY P53396 1/20 0.33

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
SCHEMBL17692576 0.88 ALDH1A1 (0.42) MEN1KMT2AALDH1A1HPGDPOLB
SCHEMBL17692570 0.86 MEN1 (0.38) ADRB3ADRB1BRD4MEN1KMT2A
SCHEMBL17692573 0.82 MEN1 (0.35) ADRB3ADRB1BRD4MEN1KMT2A
SCHEMBL12142354 0.79 RAB9A (0.47) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL17481741 0.78 ALDH1A1 (0.34) BRD4MEN1KMT2AALDH1A1HPGD
SCHEMBL13953007 0.71 NEU3 (0.47) BRD4KMT2AKDM4ECFDACLY
SCHEMBL13335354 0.71 KDM4E (0.32) BRD4MEN1KMT2AHPGDKDM4E
SCHEMBL12303764 0.69 RAB9A (0.40) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL23895135 0.69 AKR1C2 (0.45) ADRB3ALDH1A1
SCHEMBL17914310 0.68 HDAC8 (0.50) MEN1KMT2AACLY

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-20160111626-A1 FLEXIBLE CONDUCTIVE MATERIAL AND TRANSDUCER SUMITOMO RIKO COMPANY LIMITED (JP) 2016-04-21 — — US disclosed
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