SCHEMBL9320716

SCHEMBL9320716

OCc1ccc(C2=CCC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.41
TSHR P16473 1/20 0.40
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
ESR2 Q92731 1/20 0.36
KIF11 P52732 1/20 0.36
VHL P40337 1/20 0.35
ELOC Q15369 1/20 0.35
ELOB Q15370 1/20 0.35
LTA4H P09960 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35

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
SCHEMBL11862219 0.85 ACMSD (0.47) PTGS2TSHRMKNK1MKNK2HDAC2
SCHEMBL7801462 0.76 LSS (0.33)
SCHEMBL9090385 0.76 CA1 (0.35) CA1CA2
SCHEMBL11310791 0.76 MKNK1 (0.56) PTGS2TSHRMKNK1MKNK2PRSS1
SCHEMBL679970 0.76 MKNK1 (0.56) PTGS2TSHRMKNK1MKNK2PRSS1
SCHEMBL9811873 0.74 LMNA (0.59) TSHRCA2PTGS1
SCHEMBL14067029 0.73 MAPK1 (0.46)
SCHEMBL2424766 0.73 PTGS2 (0.33) PTGS2TSHRMKNK1MKNK2PDCD1
SCHEMBL9120467 0.73 CALM1 (0.52) LTA4HCA12CA1CA2CA9
SCHEMBL10760848 0.73 SIGMAR1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117986848-A Pultruded polyurethane door and window composite material and preparation method thereof 河北聚久复合材料有限公司 2024-05-07 CN claimed
US-5349095-A Process for preparing hydroxyalkylbenzocyclobutenes THE DOW CHEMICAL COMPANY (US) 1994-09-20 US claimed
US-5264613-A Process for preparing ester of hydroxymethylbenzocyclobutenes THE DOW CHEMICAL COMPANY (US) 1993-11-23 US claimed
CN-117986848-A Pultruded polyurethane door and window composite material and preparation method thereof 河北聚久复合材料有限公司 2024-05-07 CN disclosed
CN-117986848-A Pultruded polyurethane door and window composite material and preparation method thereof 河北聚久复合材料有限公司 2024-05-07 CN disclosed
US-5349095-A Process for preparing hydroxyalkylbenzocyclobutenes THE DOW CHEMICAL COMPANY (US) 1994-09-20 US disclosed
US-5264613-A Process for preparing ester of hydroxymethylbenzocyclobutenes THE DOW CHEMICAL COMPANY (US) 1993-11-23 US disclosed
US-5264613-A Process for preparing ester of hydroxymethylbenzocyclobutenes THE DOW CHEMICAL COMPANY (US) 1993-11-23 US disclosed
EP-0251357-B1 ENGINEERING THERMOPLASTICS CONTAINING PENDANT BENZOCYCLOBUTENE GROUPS SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1991-07-17 EP disclosed
EP-0251357-A1 Engineering thermoplastics containing pendant benzocyclobutene groups SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-01-07 EP disclosed
US-4708994-A CURING, CROSSLINKING; SOLVENT RESISTANCE SHELL OIL COMPANY (US) 1987-11-24 US disclosed