SCHEMBL13328313

SCHEMBL13328313

Cc1sc(NC(=O)c2ccc(N3CCC(c4cccc(C(F)(F)F)c4)CC3)nc2)nc1-c1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MPL P40238 9/20 0.50
ADORA3 P0DMS8 6/20 0.49
TRPV1 Q8NER1 2/20 0.42
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
CFTR P13569 1/20 0.40

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
SCHEMBL2300487 0.93 ADORA3 (0.53) MPLADORA3KDM4EMAPT
SCHEMBL13328319 0.91 ADORA3 (0.47) MPLADORA3KDM4EMAPT
SCHEMBL13328316 0.90 ADORA3 (0.50) MPLADORA3KDM4EMAPT
SCHEMBL13364019 0.90 PLTP (0.47) MPLADORA3KDM4EMAPT
SCHEMBL13328324 0.88 ADORA3 (0.56) MPLADORA3KDM4EMAPT
SCHEMBL2358584 0.83 ADORA3 (0.51) MPLADORA3
SCHEMBL13328317 0.82 ADORA3 (0.61) MPLADORA3KDM4EMAPT
SCHEMBL2363666 0.82 ADORA3 (0.50) ADORA3KDM4EMAPT
SCHEMBL2302579 0.81 ADORA3 (0.50) MPLADORA3KDM4EMAPTCFTR
SCHEMBL3315591 0.81 ADORA3 (0.50) MPLADORA3KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324385-B2 Diacylglycerol acyltransferase inhibitors MADRIGAL PHARMACEUTICALS, INC. (US) 2012-12-04 US disclosed
US-8324385-B2 Diacylglycerol acyltransferase inhibitors MADRIGAL PHARMACEUTICALS, INC. (US) 2012-12-04 US disclosed
WO-2010056506-A1 DIACYLGLYCEROL ACLYTRANSFERASE INHIBITORS VIA PHARMACEUTICALS, INC. (US) 2010-05-20 WO disclosed
US-20100113782-A1 Diacylglycerol Acyltransferase Inhibitors MADRIGAL PHARMACEUTICALS, INC. 2010-05-06 US disclosed
US-20100113782-A1 Diacylglycerol Acyltransferase Inhibitors MADRIGAL PHARMACEUTICALS, INC. 2010-05-06 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-20100113782-A1 Diacylglycerol Acyltransferase Inhibitors DGAT2, DGAT1, MOGAT2 MPL 1091/4885ADORA3 1254/4885TRPV1 3098/4885

“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.