SCHEMBL933946

SCHEMBL933946

COc1ccc(CCCCCC(N)=O)cc1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.59
F2RL1 P55085 1/20 0.57
CALM1 P0DP23 1/20 0.56
LTB4R Q15722 1/20 0.54
IGF1R P08069 1/20 0.54
ALOX15 P16050 1/20 0.54
POLB P06746 1/20 0.54
TAAR1 Q96RJ0 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
SCHEMBL13522667 1.00 ALOX5 (0.59) ALOX5F2RL1CALM1LTB4RIGF1R
SCHEMBL20019549 0.98 ALOX5 (0.61) ALOX5F2RL1CALM1IGF1RALOX15
SCHEMBL659052 0.93 ALOX5 (0.68) ALOX5F2RL1CALM1POLBTAAR1
SCHEMBL8843136 0.88 CNR1 (0.60) ALOX5F2RL1CALM1
SCHEMBL1413843 0.87 F2RL1 (0.68) ALOX5F2RL1POLBTAAR1
SCHEMBL9235000 0.86 ALOX5 (0.59) ALOX5F2RL1CALM1LTB4RIGF1R
SCHEMBL9484086 0.86 LTB4R (0.69) ALOX5F2RL1CALM1LTB4R
SCHEMBL9663959 0.86 LTB4R (0.69) ALOX5F2RL1CALM1LTB4R
SCHEMBL8003026 0.86 ALOX5 (0.59) ALOX5F2RL1CALM1LTB4RIGF1R
SCHEMBL11637942 0.86 ALOX5 (0.59) ALOX5F2RL1CALM1LTB4RIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011006935-A2 TETRAZOLE DERIVATIVES MERCK SERONO S.A. (CH) 2011-01-20 WO disclosed