SCHEMBL5319348

SCHEMBL5319348

O=Cc1cccc2c1oc1ccc(Cl)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 7/20 0.51
PTPN1 P18031 1/20 0.48
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
GABRP O00591 4/20 0.42
GABRD O14764 4/20 0.42
GABRA1 P14867 4/20 0.42
GABRB1 P18505 4/20 0.42
GABRG2 P18507 4/20 0.42
GABRB3 P28472 4/20 0.42
GABRA5 P31644 4/20 0.42
GABRA3 P34903 4/20 0.42
GABRA2 P47869 4/20 0.42
GABRB2 P47870 4/20 0.42
GABRA4 P48169 4/20 0.42
GABRE P78334 4/20 0.42
GABRA6 Q16445 4/20 0.42
GABRG1 Q8N1C3 4/20 0.42

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
SCHEMBL26096395 0.88 AHR (0.53) AHRPTPN1ERN1TDP1
SCHEMBL787917 0.80 MAOA (0.44) AHRPTPN1ALDH1A1LMNAKMT2A
SCHEMBL2287518 0.78 AHR (0.64) AHRALDH1A1LMNAKMT2AGPR55
SCHEMBL22511380 0.78 TTR (0.54) PTPN1ALDH1A1KMT2AERN1TDP1
SCHEMBL14476377 0.76 AHR (0.53) AHRALDH1A1LMNAKMT2AGPR55
SCHEMBL18878911 0.76 PTPN1 (0.56) AHRPTPN1KMT2AGABRPGABRD
SCHEMBL18267698 0.76 ALOX5 (0.51) AHRPTPN1GABRPGABRDGABRA1
SCHEMBL21191630 0.76 AHR (0.56) AHRALDH1A1LMNAKMT2AGPR55
SCHEMBL2958772 0.76 AHR (0.56) AHRALDH1A1LMNAKMT2AGPR55
SCHEMBL20754180 0.76 AHR (0.56) AHRALDH1A1LMNAKMT2AGPR55

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
WO-2007095495-A2 BENZODIAZEPINE GCNF MODULATORS FOR STEM CELL MODULATION PHARMACOPEIA, INC. (US) 2007-08-23 WO disclosed
WO-2007095495-A2 BENZODIAZEPINE GCNF MODULATORS FOR STEM CELL MODULATION PHARMACOPEIA, INC. (US) 2007-08-23 WO disclosed