SCHEMBL9344713

SCHEMBL9344713

CCCC[C@H]1CC[C@H](C2CCC(c3ccc(C)cc3)CC2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.47
MEN1 O00255 3/20 0.44
MAPK1 P28482 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
ESR2 Q92731 3/20 0.42
SPHK1 Q9NYA1 3/20 0.41
CYP1A2 P05177 2/20 0.40
ESR1 P03372 1/20 0.38
CYP3A4 P08684 1/20 0.38
GAA P10253 2/20 0.37
NPC1 O15118 1/20 0.37
CYP2D6 P10635 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL10766933 1.00 CYP2C9 (0.47) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL10766937 1.00 CYP2C9 (0.47) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL10760215 0.95 CYP2C9 (0.46) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL10760223 0.95 CYP2C9 (0.46) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL10760219 0.95 CYP2C9 (0.46) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL11456274 0.95 CYP2C9 (0.50) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL11457475 0.95 CYP2C9 (0.50) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL10610461 0.95 CYP2C9 (0.50) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL10765742 0.94 SPHK1 (0.46) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL10765736 0.94 SPHK1 (0.46) CYP2C9MEN1MAPK1KMT2AMAPT

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
EP-0393636-B1 Liquid crystal composition and liquid crystal display using said composition CHISSO CORP (JP) 1994-07-20 EP disclosed
US-5258135-A Multiplexed displays, supertwisted birefringence effect CHISSO CORPORATION (JP) 1993-11-02 US disclosed
EP-0432780-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY USING SAID COMPOSITION CHISSO CORPORATION (JP) 1993-07-21 EP disclosed
US-5102577-A Supertwisted birefringence system CHISSO CORPORATION (JP) 1992-04-07 US disclosed
EP-0432780-A1 Liquid crystal composition and liquid crystal display using said composition CHISSO CORPORATION (JP) 1991-06-19 EP disclosed
EP-0393636-A2 Liquid crystal composition and liquid crystal display using said composition CHISSO CORPORATION (JP) 1990-10-24 EP disclosed
EP-0094487-B1 HYDROTERPHENYLS, THEIR PREPARATION AND THEIR USE IN DIELECTRIC LIQUID CRYSTAL MATERIAL MERCK PATENT GmbH (DE) 1987-09-09 EP disclosed
US-4620938-A Hydroterphenyls MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-11-04 US disclosed
EP-0094487-A1 Hydroterphenyls, their preparation and their use in dielectric liquid crystal material MERCK PATENT GmbH (DE) 1983-11-23 EP disclosed