SCHEMBL16183294

SCHEMBL16183294

Oc1cc(-c2cccnc2)nc2cc(Br)ccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.58
RXFP1 Q9HBX9 3/20 0.58
NPSR1 Q6W5P4 4/20 0.57
PRNP P04156 1/20 0.57
PPARG P37231 1/20 0.57
NR2E3 Q9Y5X4 1/20 0.57
NCOR2 Q9Y618 1/20 0.57
MEN1 O00255 5/20 0.53
MAPT P10636 4/20 0.53
GLA P06280 1/20 0.49
POLB P06746 1/20 0.49
CYP11B1 P15538 1/20 0.49
CYP11B2 P19099 1/20 0.49
LMNA P02545 2/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
USP2 O75604 1/20 0.47

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
SCHEMBL26999154 0.84 RXFP1 (0.54) KMT2ARXFP1MEN1MAPTGLA
SCHEMBL4854898 0.82 DHODH (0.63) KMT2AMEN1MAPTCYP11B1LMNA
SCHEMBL14358473 0.81 CYP11B1 (0.49) KMT2ARXFP1NPSR1PRNPPPARG
SCHEMBL26998325 0.76 KMT2A (0.48) KMT2ARXFP1NPSR1PRNPPPARG
SCHEMBL7821284 0.76 KMT2A (0.81) KMT2ARXFP1NPSR1PRNPPPARG
SCHEMBL20212019 0.73 CYP19A1 (0.67) KMT2ARXFP1NPSR1PRNPPPARG
SCHEMBL3497221 0.73 RXFP1 (0.62) KMT2ARXFP1NPSR1PRNPPPARG
SCHEMBL15919447 0.72 KMT2A (0.46) KMT2ARXFP1NPSR1PRNPPPARG
SCHEMBL14727632 0.72 CYP1A2 (0.50) KMT2ARXFP1NPSR1PRNPPPARG
SCHEMBL2155318 0.72 KMT2A (0.55) KMT2ARXFP1NPSR1PRNPPPARG

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-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 US disclosed
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 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-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP2CA, PPP4C, PPP3CB KMT2A 800/4885RXFP1 3202/4885NPSR1 455/4885

“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.