SCHEMBL6149639

SCHEMBL6149639

COc1cc(C)c(C(=O)c2c(Cl)cccc2Cl)cc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL12 P48061 3/20 0.49
KDM4E B2RXH2 4/20 0.48
LMNA P02545 2/20 0.48
MAPT P10636 2/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
RECQL P46063 1/20 0.48
HSD17B10 Q99714 1/20 0.48
RORC P51449 4/20 0.45
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
POLB P06746 1/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
RAB9A P51151 2/20 0.41
APP P05067 1/20 0.40
NPC1 O15118 2/20 0.40
ALDH1A1 P00352 2/20 0.40

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
SCHEMBL6150594 0.90 CES2 (0.48) CXCL12KDM4ELMNACYP3A4RORC
SCHEMBL11011711 0.85 RORC (0.45) LMNACYP3A4RORCKMT2AMEN1
SCHEMBL6151108 0.84 ALDH1A1 (0.45) CXCL12KDM4ELMNAMAPTHPGD
SCHEMBL6307594 0.84 CES2 (0.46) CXCL12KDM4ELMNAMAPTCYP3A4
SCHEMBL6150910 0.82 RORC (0.42) CXCL12KDM4ELMNACYP3A4RORC
SCHEMBL8463397 0.81 TSHR (0.45) LMNAMAPTCYP3A4HPGDRORC
SCHEMBL8466332 0.81 RORC (0.42) CXCL12KDM4ELMNAMAPTRORC
SCHEMBL6150602 0.80 TTR (0.49) LMNAMAPTRORCCES2CES1
SCHEMBL6149893 0.80 LMNA (0.54) KDM4ELMNAMAPTCYP3A4HPGD
SCHEMBL6149650 0.80 RORC (0.41) CXCL12KDM4ELMNAMAPTRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727141-B1 Fungicidal methods, compounds and compositions containing benzophenones BASF AG (DE) 2005-11-02 EP disclosed
US-5922919-A Fungicidal methods, compounds and compositions containing benzophenones AMERICAN CYANAMID COMPANY (US) 1999-07-13 US disclosed
US-5866722-A Fungicidal methods compounds and compositions containing benzophenones AMERICAN CYANAMID COMPANY (US) 1999-02-02 US disclosed
US-5773663-A FOR CONTROL OF PHYTOPATHOGENIC FUNGI IN CROPS AMERICAN CYANAMID COMPANY (US) 1998-06-30 US disclosed
US-5679866-A CONTROLLING POWDERY MELDEW DISEASES AMERICAN CYANAMID COMPANY (US) 1997-10-21 US disclosed
EP-0727141-A2 Fungicidal methods, compounds and compositions containing benzophenones American Cyanamid Company (US) 1996-08-21 EP disclosed