SCHEMBL16184472

SCHEMBL16184472

COc1cc(-c2ccccc2F)cc2c(NC(C)C)nc(-c3cccnc3)nc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.45
▸ MEN1 O00255 5/20 0.45
▸ CLK1 P49759 1/20 0.45
▸ LMNA P02545 4/20 0.43
▸ CYP1A2 P05177 3/20 0.43
▸ CYP3A4 P08684 3/20 0.43
▸ MAPK1 P28482 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ USP2 O75604 2/20 0.43
▸ CYP2D6 P10635 2/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ CLK4 Q9HAZ1 2/20 0.43
▸ ABCB1 P08183 2/20 0.43
▸ ABCG2 Q9UNQ0 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ MAPT P10636 6/20 0.41

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
SCHEMBL16184551 0.93 KMT2A (0.41) KMT2AMEN1CLK1LMNACYP1A2
SCHEMBL16184581 0.91 MEN1 (0.46) KMT2AMEN1CLK1LMNACYP1A2
SCHEMBL16184610 0.91 MEN1 (0.46) KMT2AMEN1CLK1LMNACYP1A2
SCHEMBL16183565 0.89 CYP1A2 (0.50) KMT2AMEN1LMNACYP1A2CYP3A4
SCHEMBL16184491 0.88 USP2 (0.46) KMT2AMEN1LMNACYP1A2CYP3A4
SCHEMBL16184639 0.87 KMT2A (0.47) KMT2AMEN1CLK1LMNACYP1A2
SCHEMBL14474176 0.87 MEN1 (0.49) KMT2AMEN1CLK1LMNACYP1A2
SCHEMBL16184471 0.87 USP2 (0.48) KMT2AMEN1LMNACYP1A2CYP3A4
SCHEMBL16184487 0.87 ABCB1 (0.43) KMT2AMEN1LMNACYP1A2CYP3A4
SCHEMBL16184665 0.87 RXFP1 (0.43) KMT2AMEN1CLK1LMNACYP1A2

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 800/4885MEN1 4814/4885CLK1 1017/4885

“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.

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