SCHEMBL9328616

SCHEMBL9328616

CC(=O)OC(C)c1ccc(C(=O)OCc2ccccc2C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.46
RAB9A P51151 6/20 0.43
MAPT P10636 5/20 0.43
POLB P06746 2/20 0.43
KMT2A Q03164 2/20 0.43
PKM P14618 1/20 0.43
PPARG P37231 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
ADORA2A P29274 1/20 0.40
NPC1 O15118 4/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RXFP1 Q9HBX9 2/20 0.39
FFAR1 O14842 2/20 0.38
LMNA P02545 2/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38

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
SCHEMBL9329639 0.85 KMT2A (0.43) RAB9AMAPTPOLBKMT2APKM
SCHEMBL9329029 0.84 MAOB (0.47) MAOBRAB9AMAPTPOLBKMT2A
SCHEMBL9329611 0.83 KMT2A (0.59) RAB9AMAPTPOLBKMT2AKDM4E
SCHEMBL9329226 0.81 MAOB (0.68) MAOBRAB9AMAPTPOLBKMT2A
SCHEMBL9329587 0.80 KMT2A (0.55) RAB9AMAPTPOLBKMT2AALDH1A1
SCHEMBL3628980 0.79 ESR1 (0.61) MAOBRAB9AMAPTPOLBKMT2A
SCHEMBL471706 0.79 PPARG (0.61) MAOBRAB9AMAPTPOLBKMT2A
SCHEMBL9329080 0.77 CA12 (0.50) RAB9AMAPTKMT2AKDM4EALDH1A1
SCHEMBL9328620 0.76 PDCD1 (0.51) RAB9AMAPTPOLBKMT2AALDH1A1
SCHEMBL6394260 0.75 ESR1 (0.56) MAOBRAB9AMAPTPOLBKMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5332675-A Liquid crystals SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-07-26 US disclosed
EP-0289307-B1 OPTICALLY ACTIVE AROMATIC CARBOXYLIC ACID DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-07-08 EP disclosed
US-5019298-A Optically active aromatic carboxylic acid derivatives and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-28 US disclosed
EP-0289307-A2 Optically active aromatic carboxylic acid derivatives and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-02 EP disclosed