SCHEMBL14802405

SCHEMBL14802405

Cc1cc(-c2cnccn2)cnc1C(=O)NCc1ccc(-c2ccnc(C(C)(F)F)c2)nc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 10/20 0.46
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
RAB9A P51151 1/20 0.38
PORCN Q9H237 2/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL249298 0.94 WNT3A (0.47) WNT3ASMN1; SMN2L3MBTL1RAB9APORCN
SCHEMBL17243393 0.87 WNT3A (0.48) WNT3ASMN1; SMN2L3MBTL1RAB9APORCN
SCHEMBL17243383 0.84 L3MBTL1 (0.46) WNT3ASMN1; SMN2L3MBTL1RAB9ACYP1A2
SCHEMBL248044 0.79 WNT3A (0.49) WNT3ASMN1; SMN2RAB9ACYP1A2CYP2C9
SCHEMBL248928 0.78 KDM1A (0.52) WNT3AL3MBTL1
SCHEMBL17243388 0.78 WNT3A (0.52) WNT3ASMN1; SMN2RAB9APORCNCYP1A2
SCHEMBL14802382 0.77 HDAC1 (0.52) WNT3ASMN1; SMN2L3MBTL1RAB9ACYP1A2
SCHEMBL17243395 0.77 WNT3A (0.51) WNT3ASMN1; SMN2L3MBTL1PORCN
SCHEMBL248694 0.77 HPGDS (0.47) WNT3ASMN1; SMN2L3MBTL1CYP1A2CYP2C9
SCHEMBL17243392 0.76 WNT3A (0.51) WNT3ASMN1; SMN2PORCNCYP1A2CYP2C9

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-9181235-B2 Substituted pyridines for modulating the WNT signaling pathway NOVARTIS AG (CH) 2015-11-10 US disclosed
US-20130079328-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY NOVARTIS AG (CH) 2013-03-28 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-20130079328-A1 COMPOSITIONS AND METHODS FOR MODULATING THE WNT SIGNALING PATHWAY WNT3A, WNT1, WNT3 WNT3A 1/4885SMN1; SMN2 4423/4885L3MBTL1 1588/4885

“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.