SCHEMBL10697363

SCHEMBL10697363

COc1ccc(CCCC(C)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.59
IGF1R P08069 1/20 0.53
ALOX15 P16050 1/20 0.53
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ALOX5 P09917 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
ALDH1A1 P00352 3/20 0.49
SIGMAR1 Q99720 1/20 0.48
F2RL1 P55085 1/20 0.47
SLC6A4 P31645 1/20 0.47
KMT2A Q03164 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
SCHEMBL12888466 1.00 CALM1 (0.59) CALM1IGF1RALOX15HTTSMN1; SMN2
SCHEMBL2238188 0.89 HTT (0.59) CALM1HTTSMN1; SMN2TAAR1ALDH1A1
SCHEMBL2942342 0.89 HTT (0.59) CALM1HTTSMN1; SMN2TAAR1ALDH1A1
SCHEMBL8158210 0.85 CALM1 (0.58) CALM1IGF1RALOX15HTTSMN1; SMN2
SCHEMBL6989069 0.82 CALM1 (0.56) CALM1IGF1RALOX15HTTSMN1; SMN2
Carbon Monoxide SCHEMBL6904840 0.82 ALDH1A1 (0.54) CALM1HTTSMN1; SMN2TAAR1ALDH1A1
SCHEMBL10654362 0.81 SLC6A4 (0.61) CALM1IGF1RALOX15HTTSMN1; SMN2
SCHEMBL1238082 0.80 LDHA (0.56) CALM1ALOX5ALDH1A1F2RL1KMT2A
SCHEMBL1237034 0.80 LDHA (0.56) CALM1ALOX5ALDH1A1F2RL1KMT2A
SCHEMBL1236958 0.80 LDHA (0.56) CALM1ALOX5ALDH1A1F2RL1KMT2A

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
EP-0267439-A2 Alpha-(phenylalkyl) pyridinealkanol derivatives G.D. Searle & Co. (US) 1988-05-18 EP disclosed