SCHEMBL16675922

SCHEMBL16675922

Cc1cccc(CC(=O)/N=C(\Nc2cc(C)[nH]n2)NC(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK7 P50613 1/20 0.44
CCNH P51946 1/20 0.44
MNAT1 P51948 1/20 0.44
ANO1 Q5XXA6 1/20 0.43
CCNA2 P20248 3/20 0.41
CDK2 P24941 3/20 0.41
CCNA1 P78396 3/20 0.41
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
CTBP2 P56545 1/20 0.37
CACNA1G O43497 1/20 0.36
CACNA1H O95180 1/20 0.36
CACNA1I Q9P0X4 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36

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
SCHEMBL18556898 0.88 RAB9A (0.49) CDK7CCNHMNAT1CCNA2CDK2
SCHEMBL16675928 0.84 NPC1 (0.39) CDK7CCNHMNAT1ANO1CCNA2
SCHEMBL16675926 0.79 CCNA2 (0.41) CCNA2CDK2CCNA1NPC1RAB9A
SCHEMBL16675921 0.78 CCNA2 (0.40) CCNA2CDK2CCNA1NPC1RAB9A
SCHEMBL16675907 0.77 CDK2 (0.46) CDK7CCNHMNAT1CCNA2CDK2
SCHEMBL16682132 0.76 CCNA2 (0.46) CCNA2CDK2CCNA1CTBP2
SCHEMBL16675912 0.75 RET (0.39) CDK7CCNHMNAT1ANO1CCNA2
SCHEMBL16675923 0.74 RET (0.38) CCNA2CDK2CCNA1NPC1RAB9A
SCHEMBL16675931 0.74 CDK2 (0.37) CCNA2CDK2CCNA1NPC1RAB9A
SCHEMBL16682182 0.73 CACNA1H (0.41) ANO1CDK2CACNA1GCACNA1HCACNA1I

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-9580391-B2 Saturated acyl guanidine for inhibition of F1F0-ATPase LYCERA CORPORATION (US) 2017-02-28 US disclosed
US-20150119439-A1 SATURATED ACYL GUANIDINE FOR INHIBITION OF F1F0-ATPASE WILMINGTON TRUST, NATIONAL ASSOCIATION 2015-04-30 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-20150119439-A1 SATURATED ACYL GUANIDINE FOR INHIBITION OF F1F0-ATPASE ATP5F1A, ATP5F1D, ATP5F1C CDK7 3027/4885CCNH 2940/4885MNAT1 1843/4885

“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.