SCHEMBL15216611

SCHEMBL15216611

CCc1cc2ncn(C3CCCCO3)c2cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.41
YTHDC1 Q96MU7 1/20 0.38
CYP4F2 P78329 2/20 0.38
CYP4A11 Q02928 2/20 0.38
LMNA P02545 1/20 0.37
ESR1 P03372 1/20 0.37
MAPT P10636 1/20 0.37
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 2/20 0.36
HSD17B10 Q99714 2/20 0.36
CYP2C9 P11712 1/20 0.36
NFKB1 P19838 1/20 0.36
MAPK1 P28482 1/20 0.36
APEX1 P27695 1/20 0.36
PI4KA P42356 1/20 0.36
BLM P54132 1/20 0.36
ADCY1 Q08828 1/20 0.36
PI4K2B Q8TCG2 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
SCHEMBL14723485 0.88 YTHDC1 (0.42) CYP2C19YTHDC1CYP4F2CYP4A11LMNA
SCHEMBL14723472 0.88 CYP2C19 (0.39) CYP2C19YTHDC1CYP4F2CYP4A11LMNA
SCHEMBL14722645 0.83 CYP2C19 (0.39) CYP2C19YTHDC1CYP4F2CYP4A11LMNA
SCHEMBL14722928 0.81 CYP2C19 (0.43) CYP2C19YTHDC1CYP4F2CYP4A11LMNA
SCHEMBL14723427 0.80 HTR2C (0.37) CYP2C19YTHDC1CYP4F2CYP4A11LMNA
SCHEMBL18309163 0.79 CYP2C19 (0.42) CYP2C19YTHDC1CYP4F2CYP4A11ALDH1A1
SCHEMBL14723191 0.79 CYP2C19 (0.39) CYP2C19YTHDC1CYP4F2CYP4A11LMNA
SCHEMBL14723246 0.79 CYP4F2 (0.38) CYP2C19YTHDC1CYP4F2CYP4A11LMNA
SCHEMBL15209028 0.78 CYP2C19 (0.41) CYP2C19YTHDC1CYP4F2CYP4A11LMNA
SCHEMBL14722763 0.77 CYP2C19 (0.39) CYP2C19YTHDC1CYP4F2CYP4A11LMNA

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-8637537-B2 Serine/threonine kinase inhibitors GENENTECH, INC. (US) 2014-01-28 US disclosed
US-20130225620-A1 SERINE/THREONINE KINASE INHIBITORS GENENTECH, INC. (US) 2013-08-29 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-20130225620-A1 SERINE/THREONINE KINASE INHIBITORS PAK1, AKT1, RB1 CYP2C19 4851/4885YTHDC1 4494/4885CYP4F2 4881/4885

“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.