SCHEMBL570975

SCHEMBL570975

CCNC(=O)c1cc2cc(C=CC(=O)c3ccc(C)cc3)cc(C(C)CC)c2oc1=O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.39
MAPT P10636 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
MAOA P21397 3/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CYP1B1 Q16678 2/20 0.36
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
CYP1A1 P04798 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
SCHEMBL570973 1.00 MAOB (0.39) MAOBMAPTRXFP1MAOACA1
SCHEMBL570888 0.92 MAOB (0.39) MAOBMAPTRXFP1MAOACA1
SCHEMBL570890 0.92 MAOB (0.39) MAOBMAPTRXFP1MAOACA1
SCHEMBL571130 0.89 GPR35 (0.41) MAOBMAPTMAOACA1CA2
SCHEMBL15166658 0.89 GPR35 (0.41) MAOBMAPTMAOACA1CA2
SCHEMBL570599 0.86 MAOB (0.44) MAOBMAPTMAOACA1CA2
SCHEMBL15166677 0.86 MAOB (0.44) MAOBMAPTMAOACA1CA2
SCHEMBL570824 0.86 CYP3A4 (0.41) MAOBMAPTMAOACA1CA2
SCHEMBL570825 0.86 CYP3A4 (0.41) MAOBMAPTMAOACA1CA2
SCHEMBL12504932 0.81 DHODH (0.44) MAOBMAPTMAOACYP1B1POLB

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
US-8815940-B2 Coumarin-chalcones as anticancer agents COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2014-08-26 US claimed
US-20130210909-A1 COUMARIN-CHALCONES AS ANTICANCER AGENTS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-08-15 US claimed
US-8815940-B2 Coumarin-chalcones as anticancer agents COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2014-08-26 US disclosed
US-20130210909-A1 COUMARIN-CHALCONES AS ANTICANCER AGENTS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-08-15 US disclosed
EP-2601183-A1 COUMARIN-CHALCONES AS ANTICANCER AGENTS Council Of Scientific & Industrial Research (IN) 2013-06-12 EP disclosed
WO-2012017454-A1 COUMARIN-CHALCONES AS ANTICANCER AGENTS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2012-02-09 WO 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-20130210909-A1 COUMARIN-CHALCONES AS ANTICANCER AGENTS HCCS, XPO5, CIAPIN1 MAOB 4231/4885MAPT 3772/4885RXFP1 4653/4885

“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.