SCHEMBL16183249

SCHEMBL16183249

CNc1nc(-c2ccccn2)nc2c(F)c(-c3ccc(F)cc3F)ccc12

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 2/20 0.44
▸ METAP1 P53582 2/20 0.44
▸ FFAR1 O14842 6/20 0.42
▸ KDM4E B2RXH2 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ABCB1 P08183 1/20 0.39
▸ ABCG2 Q9UNQ0 1/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ TGFBR1 P36897 1/20 0.39
▸ TGFBR2 P37173 1/20 0.39
▸ MAPK14 Q16539 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL14474743 0.86 NPC1 (0.42) RAB9ANPC1TGFBR1TGFBR2
SCHEMBL16183246 0.83 METAP1 (0.45) METAP2METAP1FFAR1KDM4ELMNA
SCHEMBL14474671 0.81 L3MBTL1 (0.47) METAP2METAP1FFAR1KDM4ELMNA
SCHEMBL14474140 0.81 LMNA (0.45) METAP2METAP1FFAR1KDM4ELMNA
SCHEMBL16185147 0.79 FFAR1 (0.43) METAP2METAP1FFAR1KDM4ELMNA
SCHEMBL16184348 0.78 NPC1 (0.41) KDM4ERAB9ANPC1TGFBR1TGFBR2
SCHEMBL16184359 0.78 PIM1 (0.39) METAP2METAP1KDM4ELMNASMN1; SMN2
SCHEMBL16184343 0.74 WNT1 (0.41) ABCG2RAB9ANPC1TGFBR1
SCHEMBL16185151 0.74 L3MBTL1 (0.45) METAP2METAP1FFAR1KDM4ELMNA
SCHEMBL16184340 0.74 NPC1 (0.38) KDM4EHTTSMN1; SMN2RAB9AMEN1

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 1 patent. 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

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 METAP2 2043/4885METAP1 1661/4885FFAR1 4087/4885

“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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