SCHEMBL13577164

SCHEMBL13577164

CC(Cc1ccccc1)Oc1ccc(Cl)c(N)c1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 9/20 0.50
▸ PPARA Q07869 9/20 0.50
▸ DRD4 P21917 1/20 0.50
▸ IGLV6-57 P01721 1/20 0.46
▸ HPGD P15428 1/20 0.41
▸ SLC6A2 P23975 2/20 0.41
▸ TAAR1 Q96RJ0 2/20 0.41
▸ SLC6A3 Q01959 2/20 0.41
▸ MAOA P21397 1/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ ADORA2A P29274 1/20 0.41
▸ ADORA1 P30542 1/20 0.41
▸ LNPEP Q9UIQ6 1/20 0.39
▸ LTA4H P09960 1/20 0.39

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
SCHEMBL13577006 0.78 ALOX5 (0.47) DRD4IGLV6-57SLC6A4
SCHEMBL13577130 0.78 ALOX5 (0.47) DRD4IGLV6-57SLC6A4
SCHEMBL13577129 0.78 ALOX5 (0.47) DRD4IGLV6-57SLC6A4
SCHEMBL13577155 0.78 SLC6A4 (0.52) DRD4IGLV6-57SLC6A4
SCHEMBL10653792 0.77 TP53 (0.45) DRD4HPGD
SCHEMBL13577159 0.76 SLC6A4 (0.41) PPARGPPARADRD4HPGDSLC6A4
SCHEMBL31442495 0.74 DRD4 (0.62) DRD4SLC6A2SLC6A3MAOA
SCHEMBL31442496 0.74 DRD4 (0.62) DRD4SLC6A2SLC6A3MAOA
SCHEMBL4302160 0.74 DRD4 (0.62) DRD4SLC6A2SLC6A3MAOA
SCHEMBL28735087 0.74 SIGMAR1 (0.52) PPARGPPARAIGLV6-57SLC6A2TAAR1

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
US-9040693-B2 Fused heterocyclic derivative, medicinal composition containing the same, and medicinal use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2015-05-26 — — US disclosed
US-9040693-B2 Fused heterocyclic derivative, medicinal composition containing the same, and medicinal use thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2015-05-26 — — US disclosed
US-20090325900-A1 FUSED HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 — — US disclosed
US-20090325900-A1 FUSED HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-12-31 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090325900-A1 FUSED HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF SHBG, CYP19A1, NR5A1 PPARG 41/4885PPARA 72/4885DRD4 2403/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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