SCHEMBL7847724

SCHEMBL7847724

O=c1[nH]c(Cl)c(Cc2ccccc2)c(=O)n1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 1/20 0.55
▸ ALDH1A1 P00352 5/20 0.54
▸ HPGD P15428 4/20 0.54
▸ KDM4E B2RXH2 3/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ CYP3A4 P08684 1/20 0.46
▸ P2RX3 P56373 1/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ LMNA P02545 3/20 0.44
▸ HTT P42858 2/20 0.44
▸ PGR P06401 1/20 0.44
▸ GSK3A P49840 1/20 0.43
▸ GSK3B P49841 1/20 0.43
▸ NR3C1 P04150 1/20 0.43
▸ ADORA1 P30542 1/20 0.43
▸ DAO P14920 1/20 0.41

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
SCHEMBL10048444 0.92 P2RX3 (0.56) TYMPALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL2672364 0.89 PGR (0.53) TYMPALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL2672956 0.83 NR3C1 (0.59) TYMPALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL17917621 0.83 HPGD (0.53) TYMPALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL28178755 0.83 ALDH1A1 (0.53) TYMPALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL7834105 0.79 ALDH1A1 (0.55) TYMPALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL5253014 0.79 HPGD (0.55) ALDH1A1HPGDKDM4ESMN1; SMN2CYP3A4
SCHEMBL11680681 0.78 TYMP (0.49) TYMPALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL15180969 0.77 P2RX3 (0.46) TYMPSMN1; SMN2CYP3A4P2RX3MEN1
SCHEMBL7844750 0.75 HPGD (0.51) ALDH1A1HPGDKDM4ESMN1; SMN2CYP3A4

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-0767790-B1 CONDENSED IMIDAZOLE COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-12-12 — — EP disclosed
US-5840732-A ANTIDIABETIC AGENTS, AUTOIMMUNE DISEASES OR IMMUNOSUPPRESSANTS TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 1998-11-24 — — US disclosed
EP-0767790-A1 CONDENSED IMIDAZOLE COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-04-16 — — EP disclosed
WO-1995035296-A1 CONDENSED IMIDAZOLE COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-12-28 — — WO disclosed
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