SCHEMBL2363996

SCHEMBL2363996

O=C(Nc1nc(-c2ccccc2)cs1)c1ccc(N2CCC(c3cccc(C(F)(F)F)c3)CC2)nc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MPL P40238 8/20 0.59
MAPT P10636 3/20 0.48
MAPK1 P28482 2/20 0.48
KDM4E B2RXH2 2/20 0.48
POLB P06746 1/20 0.48
PHGDH O43175 2/20 0.46
ADORA3 P0DMS8 1/20 0.46
CFTR P13569 1/20 0.45
LMNA P02545 1/20 0.45
SCD O00767 1/20 0.45

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
SCHEMBL2304751 0.87 MPL (0.48) MPLMAPTMAPK1ADORA3
SCHEMBL2300487 0.85 ADORA3 (0.53) MPLMAPTKDM4EPOLBADORA3
SCHEMBL2358584 0.83 ADORA3 (0.51) MPLADORA3
SCHEMBL2363666 0.80 ADORA3 (0.50) MAPTKDM4EADORA3LMNA
SCHEMBL13328319 0.79 ADORA3 (0.47) MPLMAPTKDM4EPOLBADORA3
SCHEMBL3307894 0.79 MLYCD (0.51) MAPTKDM4ELMNA
SCHEMBL13328313 0.79 MPL (0.50) MPLMAPTKDM4EADORA3CFTR
SCHEMBL13364019 0.79 PLTP (0.47) MPLMAPTKDM4EPOLBADORA3
SCHEMBL13328316 0.79 ADORA3 (0.50) MPLMAPTKDM4EADORA3
SCHEMBL13328324 0.77 ADORA3 (0.56) MPLMAPTMAPK1KDM4EPOLB

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-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
EP-2350311-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS Via Pharmaceuticals, Inc. (US) 2011-08-03 EP 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 1091/4885MAPT 4008/4885MAPK1 2315/4885

“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.