SCHEMBL6933475

SCHEMBL6933475

CCCCCCC#Cc1ccc(CO)cc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.64
FFAR4 Q5NUL3 1/20 0.64
MMP2 P08253 1/20 0.55
MMP12 P39900 1/20 0.55
TNK2 Q07912 1/20 0.47
KCNH2 Q12809 4/20 0.46
GPR84 Q9NQS5 1/20 0.40

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
SCHEMBL6936496 0.95 FFAR1 (0.59) FFAR1FFAR4MMP2MMP12TNK2
SCHEMBL4240942 0.89 FFAR1 (0.52) FFAR1FFAR4MMP2MMP12TNK2
SCHEMBL6938030 0.89 FFAR1 (0.53) FFAR1FFAR4MMP2MMP12TNK2
SCHEMBL5886652 0.87 FFAR1 (0.63) FFAR1FFAR4MMP2MMP12TNK2
SCHEMBL15921659 0.87 FFAR1 (0.69) FFAR1FFAR4MMP2MMP12TNK2
SCHEMBL6932038 0.85 FFAR1 (0.52) FFAR1FFAR4MMP2MMP12TNK2
SCHEMBL2023915 0.84 FFAR1 (0.70) FFAR1FFAR4MMP2MMP12TNK2
SCHEMBL9333090 0.84 FFAR1 (0.61) FFAR1FFAR4MMP2MMP12TNK2
SCHEMBL9332907 0.84 FFAR1 (0.61) FFAR1FFAR4MMP2MMP12TNK2
SCHEMBL9335934 0.84 FFAR1 (0.61) FFAR1FFAR4MMP2MMP12TNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014118556-A2 SELECTIVE INHIBITORS AND ALLOSTERIC ACTIVATORS OF SPHINGOSINE KINASE RESEARCH FOUNDATION OF THE CITY UNIVERSITY OF NEW YORK (US) 2014-08-07 WO disclosed
EP-0962445-B1 Acetylene compound, liquid crystal composition and liquid crystal element MITSUI CHEMICALS INC (JP) 2003-02-26 EP disclosed
US-6217793-B1 Acetylene compound, liquid crystal composition and liquid crystal element MITSUI CHEMICALS, INC. (JP) 2001-04-17 US disclosed
EP-0962445-A1 Acetylene compound, liquid crystal composition and liquid crystal element Mitsui Chemicals, Inc. (JP) 1999-12-08 EP disclosed
EP-0195097-B1 ARACHIDONIC ACID ANALOGUES, PROCESSES FOR THEIR PREPARATION AND THEIR USE IN MEDICINE BEECHAM GROUP PLC (GB) 1987-10-28 EP disclosed
US-4699995-A ANTIALLERGENS BEECHAM GROUP P.L.C. (GB) 1987-10-13 US disclosed
EP-0142145-B1 ARACHIDONIC ACID ANALOGUES, PROCESSES FOR THEIR PREPARATION AND THEIR USE IN MEDICINE BEECHAM GROUP PLC (GB) 1987-03-04 EP disclosed
EP-0195097-A1 Arachidonic acid analogues, processes for their preparation and their use in medicine BEECHAM GROUP PLC (GB) 1986-09-24 EP disclosed
EP-0142145-A2 Arachidonic acid analogues, processes for their preparation and their use in medicine BEECHAM GROUP PLC (GB) 1985-05-22 EP disclosed