SCHEMBL3684529

SCHEMBL3684529

Bc1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.46
IDO1 P14902 2/20 0.41
XPO1 O14980 1/20 0.38
ADRB1 P08588 1/20 0.37
TSHR P16473 3/20 0.36
ALDH1A1 P00352 2/20 0.36
RXRA P19793 2/20 0.35
RXRB P28702 2/20 0.35
RXRG P48443 2/20 0.35
MAPT P10636 1/20 0.35
RAPGEF4 Q8WZA2 1/20 0.35
ITGB3 P05106 1/20 0.35
ITGAV P06756 1/20 0.35
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
HIF1A Q16665 1/20 0.33
TXNRD1 Q16881 1/20 0.33
TXNRD3 Q86VQ6 1/20 0.33
TXNRD2 Q9NNW7 1/20 0.33

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
SCHEMBL29136201 0.97 CES2 (0.44) CES2IDO1XPO1ADRB1TSHR
SCHEMBL28802521 0.97 CES2 (0.44) CES2IDO1XPO1ADRB1TSHR
Water SCHEMBL27788452 0.97 CES2 (0.44) CES2IDO1XPO1ADRB1TSHR
SCHEMBL19270461 0.94 CES2 (0.40) CES2IDO1XPO1ADRB1TSHR
SCHEMBL24038121 0.84 RXRA (0.44) CES2IDO1XPO1ADRB1RXRA
SCHEMBL12086474 0.84 RXRA (0.36) CES2IDO1TSHRALDH1A1RXRA
SCHEMBL440959 0.83 CES2 (0.58) CES2IDO1XPO1ADRB1TSHR
SCHEMBL2665686 0.82 RAPGEF4 (0.42) CES2XPO1MAPTRAPGEF4HDAC3
SCHEMBL18380956 0.82 PTGS1 (0.39) CES2IDO1
SCHEMBL15943174 0.82 RAPGEF4 (0.41) CES2IDO1TSHRALDH1A1RAPGEF4

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 372 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116234858-B Compositions and methods for reacting organosilicon compounds with silicon-based hydrides catalyzed by fluorinated arylborane Lewis acids 美国陶氏有机硅公司 2025-05-06 CN claimed
CN-116134074-B Compositions and methods for silyl hydride reactions catalyzed by fluorinated arylborane Lewis acids 美国陶氏有机硅公司 2024-12-27 CN claimed
CN-118027090-A Method for generating silanol by oxidizing silane 吉林大学 2024-05-14 CN claimed
CN-117986422-A Ethylene/alpha-olefin copolymer and preparation method thereof 中国石油化工股份有限公司 2024-05-07 CN claimed
CN-117677653-A Silicone foam composition 陶氏环球技术有限责任公司 2024-03-08 CN claimed
CN-115246905-B Olefin polymerization catalyst, olefin polymerization catalyst component, polymerization method and application thereof 中国石油化工股份有限公司 2024-02-13 CN claimed
CN-117529516-A Silicone foam composition 陶氏环球技术有限责任公司 2024-02-06 CN claimed
CN-115246894-B Olefin polymerization catalyst, polymerization method thereof, olefin polymerization catalyst component and application 中国石油化工股份有限公司 2023-11-14 CN claimed
CN-115246906-B Olefin polymerization catalyst component, olefin polymerization catalyst, olefin polymerization method and application 中国石油化工股份有限公司 2023-09-15 CN claimed
CN-113683565-B Asymmetric hydrogenation kinetic resolution method of racemized polysubstituted dihydroisoquinoline 中国科学院化学研究所 2023-08-22 CN claimed
CN-110669063-A Alpha-boryl ketone and preparation method and application thereof 南开大学 2020-01-10 CN claimed
CN-110437183-A A method of synthesis furfuran compound UNIV ZHEJIANG TECHNOLOGY 2019-11-12 CN claimed
CN-107474077-B A kind of α diimine palladium compound catalyst and its preparation method and application containing ferrocene group 中国科学技术大学 2019-08-27 CN claimed
US-20170106358-A1 LIGAND BASED CHROMIUM CATALYST AND APPLICATION IN CATALYZING ETHYLENE OLIGOMERIZATION XIAMEN UNIVERSITY (CN) 2017-04-20 US claimed
EP-2235069-B1 NANO-LINKED METALLOCENE CATALYST COMPOSITIONS AND THEIR POLYMER PRODUCTS CHEVRON PHILLIPS CHEMICAL CO (US) 2015-11-25 EP claimed
EP-2464670-B1 PROCESSES FOR CONTROLLING THE VISCOSITY OF POLYALPHAOLEFINS CHEMTURA CORP (US) 2014-11-19 EP claimed
US-8268944-B2 Dual metallocene catalysts for polymerization of bimodal polymers Chevron Phillips Company, L.P. (US) 2012-09-18 US claimed
US-20120190804-A1 DUAL METALLOCENE CATALYSTS FOR POLYMERIZATION OF BIMODAL POLYMERS CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2012-07-26 US claimed
CN-101400709-B Polymerization catalysts for producing polymers with low levels of long chain branching CHEVRON PHILLIPS CHEMICAL CO 2012-07-18 CN claimed
EP-2464670-A1 PROCESSES FOR CONTROLLING THE VISCOSITY OF POLYALPHAOLEFINS Chemtura Corporation (US) 2012-06-20 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170106358-A1 LIGAND BASED CHROMIUM CATALYST AND APPLICATION IN CATALYZING ETHYLENE OLIGOMERIZATION CHRNE, NOD2, NOD1 CES2 1744/4885IDO1 1456/4885XPO1 1978/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.