SCHEMBL9749197

SCHEMBL9749197

CC1(C)CCc2cccc(O)c2O1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 1/20 0.37
OPRD1 P41143 2/20 0.37
AKT1 P31749 1/20 0.37
LMNA P02545 2/20 0.36
HPGD P15428 2/20 0.36
CCR5 P51681 1/20 0.36
BCL2L1 Q07817 1/20 0.36
BAD Q92934 1/20 0.36
IDO1 P14902 1/20 0.35
HTR1A P08908 1/20 0.35
HTR1B P28222 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR7 P34969 1/20 0.35
HTR6 P50406 1/20 0.35
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34

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
SCHEMBL31254039 0.82 PNMT (0.40) SSTR5OPRD1AKT1LMNAHPGD
SCHEMBL743626 0.81 LMNA (0.51) LMNA
SCHEMBL15485106 0.81 LMNA (0.51) LMNA
SCHEMBL29963948 0.81 LMNA (0.51) LMNA
SCHEMBL11223734 0.80 IDO1 (0.39) SSTR5LMNAHPGDIDO1HTR2A
SCHEMBL30609047 0.79 TRPM8 (0.40) SSTR5AKT1LMNAHPGDIDO1
SCHEMBL15075059 0.79 HTR2C (0.47) SSTR5AKT1LMNAHPGDIDO1
SCHEMBL2432021 0.78 SSTR5 (0.44) SSTR5LMNAHPGDIDO1HTR2A
SCHEMBL672668 0.77 LMNA (0.44) SSTR5LMNAHPGD
SCHEMBL11257227 0.77 LMNA (0.47) SSTR5LMNAHPGDIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0230475-B1 NOVEL UREA DERIVATIVES, PROCESSES FOR PRODUCTION THEREOF AND HERBICIDE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-03-18 EP disclosed
US-4838924-A NONPHYTOTOXIC MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-06-13 US disclosed
EP-0040741-B1 PROCESS FOR THE PREPARATION OF CHLOROFORMIC-ACID ARYL ESTERS BAYER AG (DE) 1983-06-08 EP disclosed
US-4366102-A Process for the preparation of chloroformic acid aryl esters BAYER AKTIENGESELLSCHAFT (DE) 1982-12-28 US disclosed
EP-0040741-A1 Process for the preparation of chloroformic-acid aryl esters BAYER AG (DE) 1981-12-02 EP disclosed