SCHEMBL1643380

SCHEMBL1643380

CCNc1cc(F)c([C@@H](C)NC(=O)c2ccc3nc(N(CC)CC)ccc3c2)cc1C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.38
MCHR1 Q99705 1/20 0.38
KMT2A Q03164 1/20 0.37
TP53 P04637 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
POLB P06746 2/20 0.36
CYP2C19 P33261 2/20 0.35
GFER P55789 2/20 0.35
CYP1A2 P05177 1/20 0.35
TYMS P04818 1/20 0.34
PPARG P37231 3/20 0.34
CDK6 Q00534 1/20 0.33
BRPF1 P55201 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL1643362 0.92 MCHR1 (0.35) MAPTMCHR1KMT2APPARGBRPF1
SCHEMBL1285181 0.89 MAPT (0.37) MAPTMCHR1KMT2ATP53SMN1; SMN2
SCHEMBL1285183 0.89 MAPT (0.37) MAPTMCHR1KMT2ATP53SMN1; SMN2
SCHEMBL1644704 0.86 BRPF1 (0.34) PPARGBRPF1
SCHEMBL1645220 0.85 PDE2A (0.36) PPARGBRPF1
SCHEMBL1643883 0.82 PDE2A (0.33) KMT2ASMN1; SMN2PPARGBRPF1
SCHEMBL1645194 0.82 HDAC3 (0.41) MAPTMCHR1TP53SMN1; SMN2
SCHEMBL1645409 0.79 PDE2A (0.44) PPARGNPSR1
SCHEMBL1644460 0.79 NR1H4 (0.38) MAPTPPARG
SCHEMBL1285403 0.79 KMT2A (0.34) MCHR1KMT2APPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME PFIZER INC. (US) 2012-04-12 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-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME TRPV1, TRPA1, TRPV2 MAPT 3251/4885MCHR1 4525/4885KMT2A 4280/4885

“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.