SCHEMBL9602497

SCHEMBL9602497

O=c1cc2c(nn1-c1ccc(O)cc1)-c1cc(F)ccc1CC2

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
PBRM1 Q86U86 1/20 0.37
PARP1 P09874 1/20 0.37
PARP10 Q53GL7 1/20 0.37
NR3C1 P04150 1/20 0.36
MAPK14 Q16539 2/20 0.36
SRD5A1 P18405 1/20 0.36
LMNA P02545 1/20 0.36
NPBWR1 P48145 1/20 0.36
MCHR1 Q99705 1/20 0.36
TYMS P04818 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL10365902 0.88 ALDH1A1 (0.46) ALDH1A1GAAKMT2APARP1PARP10
SCHEMBL10365979 0.87 ALDH1A1 (0.50) ALDH1A1GAAKMT2APARP1PARP10
SCHEMBL9602724 0.84 ALDH1A1 (0.46) ALDH1A1GAAKMT2AMAPK14LMNA
SCHEMBL10367575 0.82 ALDH1A1 (0.48) ALDH1A1GAAKMT2APARP1PARP10
SCHEMBL9602782 0.81 HRH3 (0.42) ALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL9602082 0.77 HRH3 (0.45) ALDH1A1GAAKMT2AMAPK14SMN1; SMN2
SCHEMBL10366783 0.76 ALDH1A1 (0.49) ALDH1A1GAAKMT2APARP1PARP10
SCHEMBL10368024 0.76 ALDH1A1 (0.50) ALDH1A1GAAKMT2APARP1PARP10
SCHEMBL9602093 0.76 HRH3 (0.39) ALDH1A1GAAKMT2AMAPK14
SCHEMBL9601997 0.76 HRH3 (0.39) ALDH1A1GAAKMT2ANR3C1MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0351435-B1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1993-08-04 EP disclosed
US-5045541-A Immunodeficiency disorders YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-09-03 US disclosed
EP-0351435-A1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-24 EP disclosed