SCHEMBL14927262

SCHEMBL14927262

Fc1cc(Cl)cc2c(-c3ccccc3)c(-c3nnn[nH]3)c(N3CCCCC3)nc12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 8/20 0.51
FABP5 Q01469 8/20 0.51
FABP3 P05413 6/20 0.51
CYP2C9 P11712 5/20 0.51
CYP2D6 P10635 4/20 0.51
CYP3A4 P08684 2/20 0.48
ACP1 P24666 2/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
HIF1A Q16665 1/20 0.36
NPY5R Q15761 2/20 0.36
ADORA2A P29274 1/20 0.36
MEN1 O00255 1/20 0.35
GFER P55789 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL14916231 0.86 FABP4 (0.68) FABP4FABP5FABP3CYP2C9CYP2D6
SCHEMBL14917126 0.85 FABP4 (0.67) FABP4FABP5FABP3CYP2C9CYP2D6
SCHEMBL14927288 0.84 FABP4 (0.70) FABP4FABP5FABP3CYP2C9CYP2D6
SCHEMBL14917385 0.82 FABP4 (0.75) FABP4FABP5FABP3CYP2C9CYP2D6
SCHEMBL14916701 0.77 FABP4 (0.70) FABP4FABP5FABP3CYP2C9CYP2D6
SCHEMBL14916663 0.76 ADORA2A (0.61) FABP4FABP5FABP3CYP2C9CYP2D6
SCHEMBL14927304 0.74 FABP4 (0.45) FABP4FABP5FABP3CYP2C9CYP2D6
SCHEMBL17356061 0.74 KDM4E (0.40) FABP4FABP5FABP3CYP2C9CYP2D6
SCHEMBL14927298 0.74 FABP4 (0.56) FABP4FABP5FABP3CYP2C9CYP2D6
SCHEMBL14927296 0.72 FABP4 (0.51) FABP4FABP5FABP3CYP2C9CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9809599-B2 Aryl-quinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2017-11-07 US disclosed
US-9809599-B2 Aryl-quinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2017-11-07 US disclosed
US-20160060270-A1 New Aryl-Quinoline Derivatives HOFFMANN-LA ROCHE INC. 2016-03-03 US disclosed
US-20160060270-A1 New Aryl-Quinoline Derivatives HOFFMANN-LA ROCHE INC. 2016-03-03 US disclosed
US-9199938-B2 Aryl-quinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2015-12-01 US disclosed
US-9199938-B2 Aryl-quinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2015-12-01 US disclosed
WO-2013064465-A1 NEW ARYL-QUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2013-05-10 WO disclosed
US-20130116234-A1 ARYL-QUINOLINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2013-05-09 US disclosed
US-20130116234-A1 ARYL-QUINOLINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2013-05-09 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 (2 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-20130116234-A1 ARYL-QUINOLINE DERIVATIVES FABP1, FABP4, FABP5 FABP4 2/4885FABP5 3/4885FABP3 4/4885
US-20160060270-A1 New Aryl-Quinoline Derivatives FABP1, FABP4, FABP5 FABP4 2/4885FABP5 3/4885FABP3 5/4885

“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.