SCHEMBL6937735

SCHEMBL6937735

[CH2]CCCCCCC(F)CCCC

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
DNM1 Q05193 2/20 0.39
LMNA P02545 1/20 0.34
CA2 P00918 1/20 0.33
OPRM1 P35372 1/20 0.32
TSHR P16473 1/20 0.32
THRB P10828 1/20 0.32
FDPS P14324 4/20 0.31
GPR84 Q9NQS5 2/20 0.31
SPHK1 Q9NYA1 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
SCHEMBL6933427 0.98 MAPT (0.35) MAPTDNM1LMNACA2OPRM1
SCHEMBL6937132 0.95 MAPT (0.43) MAPTDNM1LMNAOPRM1TSHR
SCHEMBL6934258 0.91 MAPT (0.43) MAPTDNM1LMNAOPRM1TSHR
SCHEMBL3897049 0.91 MAPT (0.43) MAPTDNM1LMNAOPRM1TSHR
SCHEMBL7757033 0.91 MAPT (0.34) MAPTLMNA
SCHEMBL200254 0.91 MAPT (0.43) MAPTDNM1LMNAOPRM1TSHR
SCHEMBL16335522 0.91 MAPT (0.43) MAPTDNM1LMNAOPRM1TSHR
SCHEMBL7755502 0.90 DNM1 (0.36) MAPTDNM1LMNACA2TSHR
SCHEMBL7755479 0.88 MAPT (0.31) MAPT
SCHEMBL4316886 0.88 MAPT (0.40) MAPTDNM1LMNAOPRM1TSHR

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
EP-0962445-B1 Acetylene compound, liquid crystal composition and liquid crystal element MITSUI CHEMICALS INC (JP) 2003-02-26 EP disclosed
EP-0751133-B1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI CHEMICALS INC (JP) 2001-09-12 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
US-5770108-A HIGH SPEED RESPONSE, MOLECULAR ORIENTATION, HIGH CONTRAST, RECEPTIVITY MITSUI TOATSU CHEMICALS, INC. (JP) 1998-06-23 US disclosed
EP-0751133-A1 Pyrimidine compound, and liquid crystal composition and liquid crystal element using the same MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-02 EP disclosed