SCHEMBL9549256

SCHEMBL9549256

COCOc1ccc(C(=O)c2ccc(OCOC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
MAPT P10636 5/20 0.50
L3MBTL1 Q9Y468 4/20 0.50
LMNA P02545 3/20 0.50
GAA P10253 3/20 0.50
MEN1 O00255 1/20 0.50
MAPK1 P28482 1/20 0.50
RAB9A P51151 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
HPGD P15428 1/20 0.50
ALDH1A1 P00352 2/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SRD5A2 P31213 1/20 0.47
FYN P06241 1/20 0.47
PPARA Q07869 1/20 0.46
ELANE P08246 3/20 0.46
PARP10 Q53GL7 1/20 0.46

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
SCHEMBL5579455 0.94 MAPT (0.59) KMT2ANPSR1MAPTL3MBTL1LMNA
SCHEMBL9549100 0.93 KMT2A (0.65) KMT2ANPSR1MAPTL3MBTL1LMNA
SCHEMBL7661858 0.93 GAA (0.62) KMT2AMAPTL3MBTL1LMNAGAA
SCHEMBL3798190 0.88 CES2 (0.59) NPSR1MAPTL3MBTL1LMNAGAA
SCHEMBL155030 0.86 CA1 (0.61) MAPK1RAB9AHTTSMN1; SMN2
SCHEMBL657699 0.86 L3MBTL1 (0.66) NPSR1MAPTL3MBTL1LMNAGAA
SCHEMBL8123793 0.86 CA1 (0.61) MAPK1RAB9AHTTSMN1; SMN2
SCHEMBL18319674 0.84 MAPT (0.47) NPSR1MAPTL3MBTL1LMNAGAA
SCHEMBL2778728 0.84 MAPT (0.47) NPSR1MAPTL3MBTL1LMNAGAA
SCHEMBL15385195 0.84 PARP10 (0.67) KMT2AALDH1A1FYNPARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1856461-A Cycloalkylene compounds as estrogen receptor modulators SMITHKLINE BEECHAM CORP (US) 2006-11-01 CN disclosed
US-5206403-A Diphenylethylene derivatives, pharmaceutical compositions containing same and treatment methods EISAI CO., LTD. (JP) 1993-04-27 US disclosed
US-5182301-A Anticoagulants EISAI CO., LTD. (JP) 1993-01-26 US disclosed
EP-0238973-B1 DIPHENYL-METHANE DERIVATIVE, PHARMACEUTICAL COMPOSITION AND USE Eisai Co., Ltd. (JP) 1992-12-02 EP disclosed
EP-0479332-A2 Diphenyl-methane derivative, pharmaceutical composition and use Eisai Co., Ltd. (JP) 1992-04-08 EP disclosed
US-5103010-A DIPHENYLETHYLENE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND TREATMENT METHOD EISAI CO., LTD. (JP) 1992-04-07 US disclosed
EP-0478001-A1 Benzophenone oxime derivatives, pharmaceutical compositions and use Eisai Co., Ltd. (JP) 1992-04-01 EP disclosed
US-5064848-A Anticoagulants EISAI CO., LTD. (JP) 1991-11-12 US disclosed
US-5034418-A Anticoagulants EISAI CO., LTD. (JP) 1991-07-23 US disclosed
US-4978767-A ANTICOAGULANTS EISAI CO., LTD. (JP) 1990-12-18 US disclosed
US-4954523-A ANTICOAGULANT EISAI CO., LTD. (JP) 1990-09-04 US disclosed
US-4886834-A ANTICOAGULANTS EISAI CO., LTD. (JP) 1989-12-12 US disclosed