SCHEMBL19985255

SCHEMBL19985255

C=CCCC1CCC(C2CCC(c3ccc(OC)c(F)c3F)CC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32
PPARA Q07869 1/20 0.32
USP30 Q70CQ3 1/20 0.31
OPRL1 P41146 3/20 0.31
PDE5A O76074 1/20 0.31
HTR1A P08908 11/20 0.31
HTR2A P28223 1/20 0.31
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL14137856 1.00 ALDH1A1 (0.32) ALDH1A1PPARGPPARDPPARAUSP30
SCHEMBL4549751 0.96 ALDH1A1 (0.34) ALDH1A1PPARGPPARDPPARAUSP30
SCHEMBL8963305 0.92 ALOX5AP (0.33)
SCHEMBL14137831 0.92 FPR2 (0.33) ALDH1A1PPARGPPARDPPARAUSP30
SCHEMBL13235371 0.90 OPRL1 (0.34) ALDH1A1PPARGPPARDPPARAOPRL1
SCHEMBL13235391 0.90 OPRL1 (0.36) ALDH1A1PPARGPPARDPPARAOPRL1
SCHEMBL16676023 0.89 OPRL1 (0.31) OPRL1HTR2A
SCHEMBL8935616 0.89 ALOX5AP (0.35)
SCHEMBL22277549 0.88 OPRL1 (0.30) OPRL1
SCHEMBL22277444 0.88 OPRL1 (0.30) OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265345-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND APPLICATION OF LIQUID CRYSTAL COMPOSITION BEIJING BAYI SPACE LCD TECHNOLOGY CO., LTD. (CN) 2023-08-24 US disclosed
US-20230265345-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND APPLICATION OF LIQUID CRYSTAL COMPOSITION BEIJING BAYI SPACE LCD TECHNOLOGY CO., LTD. (CN) 2023-08-24 US disclosed
US-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 US disclosed
US-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 US disclosed