SCHEMBL9300153

SCHEMBL9300153

Cc1nc2ccccc2n1Cc1ccc(S(=O)(=O)NC(Cc2ccccc2)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.57
ALDH1A1 P00352 1/20 0.52
PPARG P37231 4/20 0.51
GALR3 O60755 2/20 0.51
NR2F2 P24468 2/20 0.51
RAB9A P51151 1/20 0.51
S1PR1 P21453 6/20 0.50
PTAFR P25105 2/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALOX5AP P20292 1/20 0.46
RORC P51449 1/20 0.46

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
SCHEMBL8560027 0.89 PTAFR (0.59) TNFPPARGS1PR1PTAFRCYP2C19
SCHEMBL9298869 0.89 TNF (0.61) TNFALDH1A1PPARGGALR3NR2F2
SCHEMBL9299653 0.87 TNF (0.59) TNFALDH1A1PPARGGALR3NR2F2
SCHEMBL8120590 0.86 HDAC1 (0.54) TNFALDH1A1PPARGGALR3NR2F2
SCHEMBL8129724 0.85 MMP2 (0.57) TNFALDH1A1GALR3NR2F2RAB9A
SCHEMBL8129125 0.84 HDAC1 (0.53) TNFALDH1A1PPARGGALR3NR2F2
SCHEMBL9299460 0.83 TNF (0.54) TNFALDH1A1GALR3NR2F2RAB9A
SCHEMBL8134171 0.82 TNF (0.53) TNFALDH1A1PPARGGALR3NR2F2
SCHEMBL8130040 0.82 TNF (0.53) TNFALDH1A1PPARGGALR3NR2F2
SCHEMBL9298879 0.82 TNF (0.57) TNFALDH1A1PPARGGALR3NR2F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543861-A1 IMIDAZOPYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-06-02 EP claimed
WO-1992003422-A1 BENZIMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-03-05 WO claimed
US-5276153-A Antagonist of platelet activating factor for bronchodilation BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-01-04 US disclosed
EP-0543861-A1 IMIDAZOPYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-06-02 EP disclosed
US-5180723-A Hypertensives, bronchodilators, antiedemic agents BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-01-19 US disclosed
WO-1992003422-A1 BENZIMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-03-05 WO disclosed