SCHEMBL9615095

SCHEMBL9615095

CCn1c2c(c3ccccc31)CCN(C(C)=O)C2

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 1/20 0.62
▸ HDAC10 Q969S8 1/20 0.53
▸ HDAC6 Q9UBN7 1/20 0.53
▸ ENPP2 Q13822 1/20 0.50

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
SCHEMBL17486942 0.88 ENPP2 (0.54) PTGDR2ENPP2
SCHEMBL9615094 0.87 PTGDR2 (0.57) PTGDR2HDAC10HDAC6ENPP2
SCHEMBL9615138 0.86 HDAC6 (0.64) PTGDR2HDAC10HDAC6
SCHEMBL8804790 0.79 BCHE (0.56) HDAC6
SCHEMBL19132555 0.79 PTGDR2 (0.66) PTGDR2HDAC10HDAC6
SCHEMBL3082812 0.77 PTGDR2 (1.00) PTGDR2HDAC10HDAC6
SCHEMBL23148492 0.76 PTGDR2 (0.59) PTGDR2HDAC10HDAC6
SCHEMBL5373029 0.74 ENPP2 (0.53) PTGDR2HDAC10HDAC6ENPP2
SCHEMBL6421798 0.74 HDAC1 (0.55) PTGDR2HDAC6ENPP2
SCHEMBL1120439 0.73 ENPP2 (0.50) PTGDR2ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5169852-A Anorexigenic agents NEUREX CORPORATION (US) 1992-12-08 — — US disclosed
EP-0520987-A4 METHOD OF SUPPRESSING APPETITE BY ADMINISTRATION OF TETRAHYDRO--g(b)-CARBOLINE DERIVATIVES. NEUREX CORP (US) 1992-05-13 — — EP disclosed
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