SCHEMBL11320202

SCHEMBL11320202

CCCCCCCCCCCCOCCCCCCCCCCCC.O=C(O)CCC(O)(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PLA2G4B P0C869 5/20 0.43
▸ CES2 O00748 2/20 0.43
▸ CES1 P23141 2/20 0.43
▸ S1PR1 P21453 2/20 0.42
▸ S1PR3 Q99500 2/20 0.42
▸ S1PR4 O95977 1/20 0.42
▸ CYSLTR2 Q9NS75 2/20 0.40
▸ CYSLTR1 Q9Y271 2/20 0.40
▸ LTB4R Q15722 1/20 0.40
▸ TSHR P16473 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.39
▸ NAAA Q02083 1/20 0.39
▸ TP53 P04637 1/20 0.39

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
SCHEMBL11314618 1.00 PLA2G4B (0.43) PLA2G4BCES2CES1S1PR1S1PR3
SCHEMBL11307176 1.00 PLA2G4B (0.43) PLA2G4BCES2CES1S1PR1S1PR3
SCHEMBL11310480 0.95 CES1 (0.40) PLA2G4BCES2CES1S1PR1S1PR3
SCHEMBL11313558 0.90 LMNA (0.43) CES2CES1TSHRALDH1A1LMNA
SCHEMBL11519820 0.89 PPARG (0.42) CES2CES1TSHRALDH1A1LMNA
SCHEMBL11306330 0.89 PPARG (0.42) CES2CES1TSHRALDH1A1LMNA
SCHEMBL11521042 0.89 PPARG (0.42) CES2CES1TSHRALDH1A1LMNA
SCHEMBL11308380 0.84 ALDH1A1 (0.39) PLA2G4BCES2CES1TSHRALDH1A1
SCHEMBL11316884 0.84 ALDH1A1 (0.39) PLA2G4BCES2CES1TSHRALDH1A1
SCHEMBL11306319 0.84 ALDH1A1 (0.39) PLA2G4BCES2CES1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4253918-A FOR PAPER SUBSTRATES PFIZER INC. (US) 1981-03-03 — — US disclosed
US-4179478-A Process for the production of binders BAYER AKTIENGESELLSCHAFT (DE) 1979-12-18 — — US disclosed
US-4162274-A Crosslinkable urethane resins containing vinyl and carboxyl groups BAYER AKTIENGESELLSCHAFT (DE) 1979-07-24 — — US disclosed
US-4081492-A POLYEPOXIDE BINDERS BAYER AKTIENGESELLSCHAFT (DT) 1978-03-28 — — US disclosed
US-4049745-A REACTION PRODUCT OF POLYEPOXIDE AND AN ACRYLIC ACID BAYER AKTIENGESELLSCHAFT (DT) 1977-09-20 — — US disclosed
US-4014771-A POLYEPOXIDES, BINDERS FOR PRINTING INKS BAYER AKTIENGESELLSCHAFT (DT) 1977-03-29 — — US disclosed
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