SCHEMBL5204512

SCHEMBL5204512

Cc1cc(-c2c(Cl)ccc(C(=O)Cl)c2Cl)on1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
PRKAG1 P54619 1/20 0.38
PRKAA1 Q13131 1/20 0.38
PRKAB1 Q9Y478 1/20 0.38
NTRK1 P04629 1/20 0.38
CSF1R P07333 7/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
NOTUM Q6P988 1/20 0.35
POLB P06746 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL5209607 0.89 ALDH1A1 (0.54) KDM4EUSP2ALDH1A1TSHRPRKAG1
SCHEMBL8137248 0.85 NOTUM (0.47) KDM4EUSP2ALDH1A1TSHRNTRK1
SCHEMBL8137249 0.83 KDM4E (0.39) KDM4EUSP2ALDH1A1TSHRCSF1R
SCHEMBL5204516 0.77 ALDH1A1 (0.35) KDM4EUSP2ALDH1A1TSHRPRKAG1
SCHEMBL8377155 0.76 NTRK1 (0.35) KDM4EUSP2ALDH1A1TSHRPRKAG1
SCHEMBL8306233 0.75 SMN1; SMN2 (0.39) KDM4EUSP2ALDH1A1TSHRPRKAG1
SCHEMBL8310371 0.74 KDM4E (0.41) KDM4EUSP2ALDH1A1TSHRCSF1R
SCHEMBL8138255 0.73 ALDH1A1 (0.49) KDM4EUSP2ALDH1A1TSHRCSF1R
SCHEMBL6587396 0.73 KDM4E (0.40) KDM4EUSP2ALDH1A1TSHRCSF1R
SCHEMBL12603538 0.73 CSF1R (0.43) KDM4EUSP2ALDH1A1TSHRPRKAG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0958292-B1 4-(3-HETEROCYCLYL-1-BENZOYL)PYRAZOLES AND THEIR USE AS HERBICIDES BASF AG (DE) 2007-01-03 EP disclosed
US-6165944-A 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2000-12-26 US disclosed
CN-1250447-A 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides BASF AG (DE) 2000-04-12 CN disclosed
US-5948917-A INTERMEDIATE FOR THE PRODUCTION OF A HERBICIDALLY ACTIVE PYRAZOLE COMPOUND NIPPON SODA CO., LTD. (JP) 1999-09-07 US disclosed
EP-0891972-A1 3-(ISOXAZOL-5-YL)-SUBSTITUTED BENZOIC ACID DERIVATIVES AND PROCESS FOR PRODUCING THE SAME NIPPON SODA CO., LTD. (JP) 1999-01-20 EP disclosed