SCHEMBL31454259

SCHEMBL31454259

ClCc1ccccc1-c1cc(-c2cc(-c3ccccc3CCl)cc(-c3ccccc3CCl)c2)cc(-c2ccccc2CCl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.41
PTGER1 P34995 3/20 0.38
PTGER4 P35408 3/20 0.38
PTGER3 P43115 3/20 0.38
PTGER2 P43116 3/20 0.38
AURKA O14965 1/20 0.38
AURKB Q96GD4 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 2/20 0.35
ADRA2C P18825 1/20 0.33
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
ABL1 P00519 1/20 0.31
ABCB1 P08183 1/20 0.31
BCR P11274 1/20 0.31
TACR1 P25103 2/20 0.31
CYP2A6 P11509 1/20 0.31

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
SCHEMBL258354 0.88 PTGER4 (0.49) DPP4PTGER1PTGER4PTGER3PTGER2
SCHEMBL9456872 0.85 DPP4 (0.50) DPP4AURKAAURKBALDH1A1TSHR
SCHEMBL31179899 0.83 DPP4 (0.48) DPP4PTGER1PTGER4PTGER3PTGER2
SCHEMBL83911 0.83 DPP4 (0.60) DPP4PTGER1PTGER4PTGER3PTGER2
SCHEMBL736614 0.82 DPP4 (0.46) DPP4AURKAAURKBALDH1A1TSHR
Water SCHEMBL10404160 0.81 DPP4 (0.58) DPP4PTGER1PTGER4PTGER3PTGER2
SCHEMBL10896807 0.79 DPP4 (0.44) DPP4AURKAAURKBALDH1A1TSHR
Biphenyl SCHEMBL27671885 0.79 DPP4 (0.56) DPP4PTGER1PTGER4PTGER3PTGER2
SCHEMBL19002938 0.78 DPP4 (0.40) DPP4AURKAAURKBALDH1A1TSHR
SCHEMBL1308849 0.77 DPP4 (0.43) DPP4PTGER1PTGER4PTGER3PTGER2

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
CN-119978201-A Curable reactive branched isobutenyl quaternary phosphonium salt polymer, preparation method thereof, curable epoxy resin composition and waterproof and antifouling coating 中国石油化工股份有限公司 2025-05-13 CN disclosed
CN-119978198-A Reactive branched isobutenyl quaternary phosphonium salt copolymer, preparation method thereof and antibacterial coating 中国石油化工股份有限公司 2025-05-13 CN disclosed
CN-119978199-A Reactive branched isobutylene-based composite cationic salt copolymer, preparation method thereof and antibacterial coating 中国石油化工股份有限公司 2025-05-13 CN disclosed
CN-119978200-A Curable reactive branched isobutenyl cationic salt copolymer, preparation method, curable epoxy resin composition and water-resistant mildew-proof coating 中国石油化工股份有限公司 2025-05-13 CN disclosed