SCHEMBL17962654

SCHEMBL17962654

Clc1c[nH]c(Cc2ccccc2)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CALM1 P0DP23 1/20 0.42
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ LTB4R Q15722 1/20 0.38
▸ TAAR1 Q96RJ0 2/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.36
▸ TYMP P19971 1/20 0.36
▸ NR1H2 P55055 2/20 0.36
▸ NR1H3 Q13133 1/20 0.36
▸ CYP3A4 P08684 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MET P08581 1/20 0.34
▸ CTRC Q99895 2/20 0.33
▸ P2RX7 Q99572 2/20 0.33
▸ DAO P14920 1/20 0.33
▸ DRD2 P14416 1/20 0.33

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
SCHEMBL31199125 0.73 CALM1 (0.44) CALM1MEN1KMT2AALDH1A1HPGD
SCHEMBL29585113 0.67 CALM1 (0.41) CALM1MEN1KMT2AALDH1A1HPGD
SCHEMBL31257100 0.67 CALM1 (0.41) CALM1MEN1KMT2AALDH1A1HPGD
SCHEMBL11523704 0.66 CALM1 (0.58) CALM1MEN1KMT2AALDH1A1HPGD
SCHEMBL6292566 0.66 TYMP (0.49) MEN1KMT2AALDH1A1TYMPCTRC
SCHEMBL11521959 0.64 CALM1 (0.55) CALM1MEN1KMT2AALDH1A1HPGD
Diphenylmethane SCHEMBL4361124 0.64 CALM1 (1.00) CALM1ALDH1A1HPGDCYP3A4ALOX15
Diphenylmethane SCHEMBL14763944 0.64 CALM1 (1.00) CALM1ALDH1A1HPGDCYP3A4ALOX15
Diphenylmethane SCHEMBL1303 0.64 CALM1 (1.00) CALM1ALDH1A1HPGDCYP3A4ALOX15
Diphenylmethane SCHEMBL3792579 0.64 CALM1 (1.00) CALM1ALDH1A1HPGDCYP3A4ALOX15

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-2016119052-A1 COMPOSITIONS AND METHODS FOR ENHANCING ONCOLYTIC VIRUS EFFICACY OTTAWA HOSPITAL RESEARCH INSTITUTE (CA) 2016-08-04 — — WO claimed
Send feedback