SCHEMBL16301366

SCHEMBL16301366

CCOc1cc(CC)cc(-c2ccn(C)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.49
JMJD6 Q6NYC1 10/20 0.42
KMT2A Q03164 1/20 0.41
SCN4A P35499 1/20 0.40
KEAP1 Q14145 1/20 0.39
MPO P05164 1/20 0.35
FGFR2 P21802 1/20 0.34
FGFR3 P22607 1/20 0.34
CACNA2D1 P54289 1/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL10224873 0.86 CYP19A1 (0.45) CYP19A1JMJD6KMT2ASCN4AKEAP1
SCHEMBL24378643 0.79 KMT2A (0.51) CYP19A1KMT2AMPOFGFR2FGFR3
SCHEMBL25606044 0.73 KMT2A (0.56) CYP19A1JMJD6KMT2ASCN4AKEAP1
SCHEMBL12299559 0.72 KEAP1 (0.60) CYP19A1KMT2ASCN4AKEAP1MAPT
SCHEMBL16301333 0.72 SMN1; SMN2 (0.38) MAPT
SCHEMBL10272781 0.71 CYP19A1 (0.40) CYP19A1JMJD6KMT2ASCN4AKEAP1
SCHEMBL321703 0.71 NQO1 (0.50) KMT2AMAPT
SCHEMBL31510906 0.71 KMT2A (0.52) CYP19A1JMJD6KMT2ASCN4AKEAP1
SCHEMBL25610930 0.67 JMJD6 (0.57) CYP19A1JMJD6KMT2A
SCHEMBL22041269 0.67 KEAP1 (0.45) CYP19A1JMJD6KMT2ASCN4AKEAP1

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-8148367-B2 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-04-03 US disclosed
US-20100105665-A1 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-04-29 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-20100105665-A1 RENIN INHIBITORS REN, ACE, AGT CYP19A1 567/4885JMJD6 2753/4885KMT2A 4058/4885

“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.