SCHEMBL3200642

SCHEMBL3200642

OCc1c(C2c3ccccc3-c3ccccc32)ccc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 4/20 0.42
MAPT P10636 4/20 0.42
GAA P10253 2/20 0.42
TAAR1 Q96RJ0 1/20 0.42
HSD17B10 Q99714 4/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM1A O60341 1/20 0.39
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
HTR2A P28223 2/20 0.36
HPGD P15428 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
GLA P06280 1/20 0.36
TDP2 O95551 1/20 0.36
ALOX12 P18054 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
Hydrochloric Acid SCHEMBL3215554 0.78 ALDH1A1 (0.35) ALDH1A1KDM4EMAPTGAATAAR1
SCHEMBL16481156 0.78 KDM1A (0.48) ALDH1A1KDM4EMAPTGAAHSD17B10
SCHEMBL6675754 0.78 KDM1A (0.53) ALDH1A1KDM4EMAPTHSD17B10CYP1A2
SCHEMBL3224110 0.77 PTPN22 (0.48) ALDH1A1KDM4EMAPTHSD17B10CYP1A2
SCHEMBL3199343 0.77 HTR2A (0.36) ALDH1A1KDM4EMAPTGAATAAR1
SCHEMBL15413698 0.76 ALDH1A1 (0.44) ALDH1A1KDM4EMAPTGAATAAR1
Hydrochloric Acid SCHEMBL3261602 0.74 KMT2A (0.35) ALDH1A1KDM4EMAPTGAATAAR1
Hydrochloric Acid SCHEMBL3264206 0.73 KDM4E (0.35) ALDH1A1KDM4EMAPTGAATAAR1
SCHEMBL3191592 0.73 BCHE (0.44) HSD17B10CYP1A2CYP2C9CYP2C19HTR2A
SCHEMBL29175309 0.72 HTR2A (0.45) CYP1A2CA1CA2HTR2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7671226-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-02 US disclosed
EP-1426379-B1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME SUMITOMO CHEMICAL CO (JP) 2009-11-11 EP disclosed
US-7439379-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL CO., LTD. (JP) 2008-10-21 US disclosed