SCHEMBL6561604

SCHEMBL6561604

O=c1oc(-c2ccccc2O)nn1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 2/20 0.48
CA2 P00918 2/20 0.44
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.43
CHUK O15111 1/20 0.43
CASP3 P42574 1/20 0.43
TXNRD1 Q16881 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
NOX4 Q9NPH5 1/20 0.43
MAPT P10636 3/20 0.42
HSD17B10 Q99714 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
MAPK1 P28482 1/20 0.42
ESR2 Q92731 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
HTT P42858 1/20 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
SCHEMBL11381008 0.81 DCTPP1 (0.51) TSHRCASP3SENP8SENP7SENP6
SCHEMBL5753908 0.78 LMNA (0.42) CA2LMNAMAPTHSD17B10KMT2A
SCHEMBL14007602 0.78 KDM4E (0.50) LMNAMAPTHSD17B10KMT2AMEN1
SCHEMBL6560817 0.78 HSD17B10 (0.57) LMNATSHRMAPTHSD17B10KMT2A
SCHEMBL9823823 0.78 NOTUM (0.49) CHUKCASP3TXNRD1SENP8SENP7
SCHEMBL13787110 0.76 MGLL (0.45) LMNAKMT2AALDH1A1HTTCA12
SCHEMBL7804879 0.72 KDM4E (0.48) LMNAMAPTHSD17B10KMT2AMEN1
SCHEMBL16039240 0.72 HSD17B10 (0.53) LMNATSHRMAPTHSD17B10KMT2A
SCHEMBL11295396 0.72 MEN1 (0.41) LMNAMAPTHSD17B10KMT2AMEN1
SCHEMBL16037837 0.71 ALDH1A1 (0.54) LMNATSHRMAPTHSD17B10KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1071670-B1 NOVEL DIPHENYL-SUBSTITUTED 5-RING-HETEROCYCLES, METHOD FOR PRODUCING THEM AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2004-07-07 EP disclosed
US-6255327-B1 ANTIHYPOXC, ANTIISCHEMIC AGENTS BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-07-03 US disclosed
EP-1071670-A1 NOVEL DIPHENYL-SUBSTITUTED 5-RING-HETEROCYCLES, METHOD FOR PRODUCING THEM AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM KG (DE) 2001-01-31 EP disclosed
WO-1999054314-A1 NOVEL DIPHENYL-SUBSTITUTED 5-RING-HETEROCYCLES, METHOD FOR PRODUCING THEM AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA KG (DE) 1999-10-28 WO disclosed