SCHEMBL18678963

SCHEMBL18678963

C/C=C(\C)CCCc1ccc(OC)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CALM1 P0DP23 1/20 0.58
▸ ALOX5 P09917 2/20 0.57
▸ IGF1R P08069 1/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ ESR1 P03372 1/20 0.51
▸ CYP19A1 P11511 1/20 0.51
▸ ESR2 Q92731 1/20 0.51
▸ F2RL1 P55085 1/20 0.50
▸ RAB9A P51151 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ TAAR1 Q96RJ0 1/20 0.48
▸ POLB P06746 1/20 0.47

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
SCHEMBL1105476 0.80 ALOX5 (0.68) CALM1ALOX5F2RL1RAB9AALDH1A1
SCHEMBL19774530 0.79 ESR1 (0.52) CALM1IGF1RALOX15ESR1CYP19A1
SCHEMBL22839710 0.78 CALM1 (0.53) CALM1ALOX5IGF1RALOX15ESR1
SCHEMBL19223045 0.78 ATM (0.53) CYP19A1POLB
SCHEMBL244070 0.78 CALM1 (0.79) CALM1ALOX5IGF1RALOX15ESR1
SCHEMBL4254058 0.78 CALM1 (0.72) CALM1ALOX5IGF1RALOX15F2RL1
SCHEMBL22481094 0.77 HTT (0.53) CALM1ALOX15ALDH1A1
SCHEMBL659052 0.76 ALOX5 (0.68) CALM1ALOX5F2RL1ALDH1A1TAAR1
SCHEMBL12832642 0.76 CALM1 (0.59) CALM1ALOX5IGF1RALOX15ESR1
SCHEMBL503646 0.76 ALOX5 (0.68) CALM1ALOX5F2RL1ALDH1A1

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-2017051305-A1 FLAME RETARDANT POLYCARBONATE COMPOSITION, A METHOD OF MAKING AND OF USING THE SAME SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2017-03-30 — — WO disclosed
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