SCHEMBL9511529

SCHEMBL9511529

CCCCCCCOc1ccc(-c2cc(CCCC)ccc2C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.63
RARB P10826 8/20 0.56
RARA P10276 2/20 0.54
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
PPARA Q07869 2/20 0.53
PPARG P37231 1/20 0.53
PLA2G4B P0C869 1/20 0.52
RARG P13631 1/20 0.52

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
SCHEMBL9511120 1.00 PTPN11 (0.63) PTPN11RARBRARATP53TSHR
SCHEMBL11133724 0.96 PTPN11 (0.61) PTPN11RARBRARATP53TSHR
SCHEMBL11138404 0.96 PTPN11 (0.61) PTPN11RARBRARATP53TSHR
SCHEMBL9485504 0.91 RARB (0.62) PTPN11RARBRARARARG
SCHEMBL7981006 0.90 PTPN11 (0.66) PTPN11RARBRARAPPARAPPARG
SCHEMBL8044985 0.90 PTPN11 (0.66) PTPN11RARBRARAPPARAPPARG
SCHEMBL9619553 0.90 PTPN11 (0.66) PTPN11RARBRARAPPARAPPARG
SCHEMBL9193021 0.90 PTPN11 (0.66) PTPN11RARBRARAPPARAPPARG
SCHEMBL28693936 0.90 RARB (0.50) PTPN11RARBRARAPPARAPPARG
SCHEMBL9501744 0.89 PTPN11 (0.64) PTPN11RARBRARAPPARAPPARG

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-0187768-B1 LIQUID CRYSTAL TEMPERATURE SENSOR AND MATERIALS FERGASON JAMES L (US) 1993-11-03 EP disclosed
US-5130828-A Liquid crystal temperature sensor and materials MANCHESTER R&D PARTNERSHIP (US) 1992-07-14 US disclosed
US-4884877-A Liquid crystal temperature sensor and materials utilizing microencapsulated liquid crystal MANCHESTER R & D PARTNERSHIP (US) 1989-12-05 US disclosed
EP-0187768-A4 LIQUID CRYSTAL TEMPERATURE SENSOR AND MATERIALS. FERGASON JAMES L 1989-03-09 EP disclosed
EP-0187768-A1 LIQUID CRYSTAL TEMPERATURE SENSOR AND MATERIALS. FERGASON JAMES L 1986-07-23 EP disclosed
WO-1985005467-A1 LIQUID CRYSTAL TEMPERATURE SENSOR AND MATERIALS FERGASON JAMES L 1985-12-05 WO disclosed
US-4385844-A THERMOSENSITIVE NON-CHLOLESTERIC COMPOUND AND ALKYLBENZOATE LIQUID CRYSTALS BECTON, DICKINSON AND COMPANY (US) 1983-05-31 US disclosed
US-4296631-A AND METHOD OF MODIFYING THE HYSTERETIC BEHAVIOR BECTON, DICKINSON AND COMPANY (US) 1981-10-27 US disclosed
US-4140016-A CHOLESTERIC LIQUID CRYSTAL THERMOMETERS, BENZOIC ESTER DERIVATIVES BECTON, DICKINSON AND COMPANY (US) 1979-02-20 US disclosed