SCHEMBL10149301

SCHEMBL10149301

CN1C(=O)C(Cc2ccccc2-c2cccc(Cl)c2)N=C(c2ccc(O)cc2)c2cc(Cl)ccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 3/20 0.56
LMNA P02545 1/20 0.56
PDE3A Q14432 1/20 0.56
PDE4D Q08499 2/20 0.49
HTR2B P41595 1/20 0.49
CCKBR P32239 12/20 0.48
CHRM2 P08172 1/20 0.48
ADRA2A P08913 1/20 0.48
GABRP O00591 1/20 0.43
GABRD O14764 1/20 0.43
CACNA1F O60840 1/20 0.43
ALB P02768 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRB1 P18505 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
AKR1C3 P42330 1/20 0.43
GABRA2 P47869 1/20 0.43

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
SCHEMBL10149907 0.94 OPRK1 (0.60) OPRK1LMNAPDE3APDE4DHTR2B
SCHEMBL10165779 0.94 OPRK1 (0.53) OPRK1LMNAPDE3APDE4DHTR2B
SCHEMBL10149190 0.91 OPRK1 (0.54) OPRK1LMNAPDE3APDE4DHTR2B
SCHEMBL10149305 0.89 OPRK1 (0.53) OPRK1LMNAPDE3APDE4DHTR2B
SCHEMBL2264923 0.89 OPRK1 (0.57) OPRK1LMNAPDE3APDE4DHTR2B
SCHEMBL11964629 0.89 OPRK1 (0.57) OPRK1LMNAPDE3APDE4DHTR2B
SCHEMBL2266878 0.89 OPRK1 (0.57) OPRK1LMNAPDE3APDE4DHTR2B
SCHEMBL608039 0.88 OPRK1 (0.56) OPRK1LMNAPDE3APDE4DHTR2B
SCHEMBL14707955 0.88 OPRK1 (0.56) OPRK1LMNAPDE3APDE4DHTR2B
SCHEMBL14064646 0.87 OPRK1 (0.55) OPRK1LMNAPDE3APDE4DHTR2B

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-2422788-A2 Benzodiazepines and compositions and uses thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2012-02-29 EP disclosed
WO-2008116156-A2 METHODS AND COMPOSITIONS FOR TREATING DISEASES AND CONDITIONS ASSOCIATED WITH MITOCHONDRIAL FUNCTION THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-09-25 WO disclosed