SCHEMBL8570929

SCHEMBL8570929

ClC(Cl)(Cl)COCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.61
KDM4E B2RXH2 1/20 0.55
POLB P06746 1/20 0.55
CA1 P00915 4/20 0.48
IDO1 P14902 1/20 0.44
ALDH1A1 P00352 2/20 0.43
AGXT P21549 1/20 0.43
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
TACR1 P25103 2/20 0.40
NAAA Q02083 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
SCHEMBL11146323 0.81 TSHR (0.67) TSHRKDM4EPOLBCA1IDO1
SCHEMBL9558574 0.80 FFAR1 (0.45) KDM4EALDH1A1
SCHEMBL10338805 0.80 IDO1 (0.46) KDM4EPOLBIDO1ALDH1A1CA2
SCHEMBL10360966 0.79 ALDH1A1 (0.46) TSHRKDM4EPOLBALDH1A1TACR1
SCHEMBL8570364 0.79 TSHR (0.64) TSHRKDM4EPOLBCA1IDO1
SCHEMBL11452375 0.78 TSHR (0.56) TSHRKDM4EPOLBCA1IDO1
SCHEMBL14406402 0.78 CA1 (0.41) TSHRCA1IDO1ALDH1A1CA2
SCHEMBL2398930 0.78 TSHR (0.50) TSHRKDM4EPOLBCA1IDO1
SCHEMBL21408338 0.77 KDM4E (0.78) TSHRKDM4EPOLBCA1IDO1
SCHEMBL1691827 0.77 TSHR (0.61) TSHRKDM4EPOLBCA1IDO1

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-5744678-A NICKEL COMPOUND, ORGANOPHOSPHORUS COMPOUND, ORGANOALUMINUM COMPOUND, CARBON-HALOGEN COMPOUNDS; CATALYST SELECTIVITY NIPPON OIL CO., LTD. (JP) 1998-04-28 US disclosed
US-5728641-A Catalyst component for the polymerization of olefins NIPPON OIL COMPANY, LIMITED (JP) 1998-03-17 US disclosed
EP-0758563-A1 OLEFIN OLIGOMERIZATION CATALYST AND PROCESS FOR THE PREPARATION OF OLEFIN OLIGOMER USING IT NIPPON OIL COMPANY, LTD. (JP) 1997-02-19 EP disclosed
EP-0587440-A2 Catalyst component for the polymerisation of olefins and process for preparing olefin polymers using same NIPPON OIL COMPANY, LIMITED (JP) 1994-03-16 EP disclosed