SCHEMBL8160657

SCHEMBL8160657

CCOc1cc(CCCCC2CCCCC2)c(OCC)cc1C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
CEL P19835 2/20 0.39
HPGD P15428 6/20 0.39
KDM4E B2RXH2 1/20 0.39
CYP1A2 P05177 1/20 0.38
ELANE P08246 1/20 0.37
GPR84 Q9NQS5 1/20 0.35
HTR1A P08908 1/20 0.34
HTR1D P28221 1/20 0.34
HTR1B P28222 1/20 0.34
CYSLTR2 Q9NS75 1/20 0.34
CYSLTR1 Q9Y271 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
SCHEMBL8152251 0.83 TAAR1 (0.50) GAAHTTCELKDM4EELANE
SCHEMBL7688328 0.74 ACHE (0.50) LMNAGAAMAPTTSHRHTT
SCHEMBL13475568 0.73 HPGD (0.51) LMNAGAAMAPTTSHRHTT
SCHEMBL12433616 0.72 SLC6A2 (0.32) LMNAGAAMAPTTSHRHTT
SCHEMBL7681834 0.72 NPC1 (0.46) LMNAGAAMAPTTSHRHTT
SCHEMBL8132262 0.71 TAAR1 (0.51) GAATSHRHTTCELKDM4E
SCHEMBL7688492 0.70 ACHE (0.44) LMNAGAAMAPTTSHRHTT
SCHEMBL13475569 0.69 HPGD (0.49) LMNAGAAMAPTTSHRHTT
SCHEMBL11871672 0.69 CNR1 (0.47) CYP1A2GPR84
SCHEMBL16493618 0.69 CYP1A2 (0.40) HPGDCYP1A2CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1017693-A1 CARBOXAMIDOTHIAZOLE DERIVATIVES, PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 2000-07-12 EP disclosed
WO-1999015525-A1 CARBOXAMIDOTHIAZOLE DERIVATIVES, PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI-SYNTHELABO (FR) 1999-04-01 WO disclosed