SCHEMBL10528583

SCHEMBL10528583

CCOC(=O)C1Cc2ccc(C=O)cc2C1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
KMT2A Q03164 4/20 0.47
KDM4E B2RXH2 4/20 0.47
GAA P10253 3/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MEN1 O00255 3/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LGMN Q99538 1/20 0.39
POLB P06746 1/20 0.38
HTT P42858 1/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL22070912 0.89 NPC1 (0.41) ALDH1A1KMT2AKDM4EGAANPC1
SCHEMBL10680765 0.89 NPC1 (0.41) ALDH1A1KMT2AKDM4EGAANPC1
SCHEMBL30967800 0.84 KMT2A (0.44) ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL22071024 0.82 TP53 (0.44) ALDH1A1KMT2AKDM4EGAANPC1
SCHEMBL31537552 0.79 KMT2A (0.49) ALDH1A1KMT2AKDM4EGAASMN1; SMN2
SCHEMBL15823733 0.79 KDM4E (0.49) ALDH1A1KMT2AKDM4EGAAMEN1
SCHEMBL794501 0.79 KMT2A (0.49) ALDH1A1KMT2AKDM4EGAASMN1; SMN2
SCHEMBL10529585 0.78 CYP4F2 (0.54) ALDH1A1KMT2AKDM4EGAASMN1; SMN2
SCHEMBL9370726 0.78 ALDH1A1 (0.54) ALDH1A1KMT2AKDM4EGAANPC1
SCHEMBL16836044 0.78 KDM4E (0.56) ALDH1A1KMT2AKDM4EGAASMN1; SMN2

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
EP-0135177-B1 BENZOCYCLOALKANE DERIVATIVES DAIICHI SEIYAKU CO., LTD. (JP) 1989-12-06 EP disclosed
US-4777257-A CARDIOVASCULAR DISORDERS DAIICHI SEIYAKU CO., LTD. (JP) 1988-10-11 US disclosed
US-4665188-A Certain [(1-imidazolyl)-lower-alkylene]-tetrahydronaphthalenecarboxylic acids or corresponding idan-carboxylic acids which are thromboxane A2 DAIICHI SEIYAKU CO., LTD. (JP) 1987-05-12 US disclosed
EP-0135177-A2 Benzocycloalkane derivatives DAIICHI SEIYAKU CO., LTD. (JP) 1985-03-27 EP disclosed