SCHEMBL3870690

SCHEMBL3870690

O=C(O)c1ccccc1C(c1ccccc1C(=O)O)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
ALOX15 P16050 2/20 0.52
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TAS2R14 Q9NYV8 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
HMGB1 P09429 1/20 0.45
HPGD P15428 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
CA7 P43166 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CA9 Q16790 1/20 0.45
NAPRT Q6XQN6 1/20 0.45
CA14 Q9ULX7 1/20 0.45
LMNA P02545 2/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL30023558 1.00 ALDH1A1 (0.52) ALDH1A1ALOX15MEN1KMT2ATAS2R14
SCHEMBL221518 0.83 LMNA (0.62) ALDH1A1ALOX15MEN1KMT2ATAS2R14
SCHEMBL30449216 0.83 LMNA (0.62) ALDH1A1ALOX15MEN1KMT2ATAS2R14
SCHEMBL30269555 0.82 TAS2R14 (0.42) ALDH1A1ALOX15MEN1KMT2ATAS2R14
SCHEMBL145576 0.82 TAS2R14 (0.42) ALDH1A1ALOX15MEN1KMT2ATAS2R14
SCHEMBL29404866 0.82 TAS2R14 (0.42) ALDH1A1ALOX15MEN1KMT2ATAS2R14
SCHEMBL3792993 0.82 ALDH1A1 (0.50) ALDH1A1ALOX15MEN1KMT2ATAS2R14
SCHEMBL8321984 0.81 NR4A1 (0.44) ALDH1A1ALOX15MEN1KMT2AKDM4E
SCHEMBL8713228 0.81 TAS2R14 (0.41) ALDH1A1ALOX15MEN1KMT2ATAS2R14
SCHEMBL23412316 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15MEN1KMT2ATAS2R14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178332-A1 Fiber Comprising Heat Curable Polyamide Resin Composition, Nonwoven Fabric And Producing Method Thereof NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-07-12 US disclosed
US-7517553-B2 Adhesive aid composition NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-04-14 US disclosed
US-7384683-B2 Substrate for flexible printed wiring board and method for manufacturing the same UNITIKA LTD. (JP) 2008-06-10 US disclosed
US-20070071984-A1 Substrate for flexible printed wiring board and method for manufacturing the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-03-29 US disclosed
US-20070026227-A1 Adhesive aid composition NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-02-01 US disclosed
EP-1666556-A1 ADHESIVE AID COMPOSITION Nippon Kayaku Kabushiki Kaisha (JP) 2006-06-07 EP disclosed
EP-1667501-A1 SUBSTRATE FOR FLEXIBLE PRINTED WIRING BOARD AND METHOD FOR MANUFACTURING SAME UNITIKA LTD. (JP) 2006-06-07 EP disclosed
US-6080833-A BIS(HYDROXYALKOXYLATED) 1,1'-SPIROBIINDAN POLYCARBONATES AND POLYESTERS POLYMERS AND CURABLE COMPOUNDS SUCH AS BIS(ACRYLATED ALKOXY)SPIROBIINDANS; ALSO POLYAMIDES AND POLYIMIDES CONTAINING SPIROBIINDAN GROUPS MITSUI CHEMICALS, INC. (JP) 2000-06-27 US disclosed
EP-0822545-A2 Optical component and spirobiindan polymer therefor MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1998-02-04 EP disclosed
EP-0612311-A1 SALTS OF POLYBENZAZOLE MONOMERS AND THEIR USE THE DOW CHEMICAL COMPANY (US) 1994-08-31 EP disclosed
US-5276128-A Polybenzoxazoles or polybenzthiazoles as dopes for fibers or films THE DOW CHEMICAL COMPANY (US) 1994-01-04 US disclosed
WO-1993008156-A1 SALTS OF POLYBENZAZOLE MONOMERS AND THEIR USE THE DOW CHEMICAL COMPANY (US) 1993-04-29 WO disclosed