SCHEMBL16184355

SCHEMBL16184355

CNc1nc(-c2cnccn2)nc2c(F)c(-c3cccc(F)c3F)ccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 2/20 0.35
▸ FEN1 P39748 2/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ CYP1A2 P05177 2/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ CYP2D6 P10635 2/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CLK4 Q9HAZ1 1/20 0.34
▸ LATS1 O95835 1/20 0.33
▸ LATS2 Q9NRM7 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ MAT2A P31153 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ TGFBR1 P36897 2/20 0.32
▸ TGFBR2 P37173 2/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ METAP2 P50579 1/20 0.32

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
SCHEMBL16184359 0.93 PIM1 (0.39) ALOX5APFEN1PIM1CYP1A2CYP3A4
SCHEMBL16184357 0.87 CYP1A2 (0.44) ALOX5APFEN1PIM1CYP1A2CYP3A4
SCHEMBL16184366 0.86 ALOX5AP (0.38) ALOX5APFEN1PIM1CYP1A2CYP3A4
SCHEMBL14474743 0.86 NPC1 (0.42) ALOX5APFEN1CYP1A2CYP3A4CYP2D6
SCHEMBL16184340 0.85 NPC1 (0.38) ALOX5APFEN1PIM1CYP1A2CYP3A4
SCHEMBL16184358 0.85 CYP1A2 (0.48) CYP1A2CYP3A4CYP2D6CYP2C19HSD17B10
SCHEMBL16184343 0.85 WNT1 (0.41) ALOX5APFEN1PIM1CYP1A2CYP3A4
SCHEMBL16184348 0.85 NPC1 (0.41) ALOX5APFEN1PIM1LATS1LATS2
SCHEMBL16184353 0.84 FEN1 (0.40) ALOX5APFEN1PIM1CYP1A2CYP3A4
SCHEMBL16184351 0.83 NPC1 (0.37) ALOX5APFEN1PIM1CYP1A2CYP3A4

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 ALOX5AP 2918/4885FEN1 3258/4885PIM1 2266/4885

“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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