SCHEMBL16184198

SCHEMBL16184198

CNc1nc(-c2cnccn2)nc2c(OC)cc(-c3cc(F)ccc3F)cc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 6/20 0.38
▸ MAP3K11 Q16584 2/20 0.38
▸ KIT P10721 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ CYP2D6 P10635 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ SCN9A Q15858 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ TGFBR2 P37173 1/20 0.35
▸ PIK3CA P42336 2/20 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
SCHEMBL14358650 0.93 MAP3K11 (0.38) TGFBR1MAP3K11KITKDM4EALDH1A1
SCHEMBL14474205 0.92 TGFBR1 (0.35) TGFBR1MAP3K11KDM4EALDH1A1LMNA
SCHEMBL16185157 0.91 CHRNA7 (0.39) TGFBR1MAP3K11KITLMNATSHR
SCHEMBL16184367 0.90 NPC1 (0.39) TGFBR1KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL16184182 0.90 CYP1A2 (0.41) KDM4EALDH1A1LMNACYP1A2CYP3A4
SCHEMBL14474183 0.89 KIT (0.39) MAP3K11KITKDM4EALDH1A1LMNA
SCHEMBL16185151 0.88 L3MBTL1 (0.45) TGFBR1KDM4EALDH1A1LMNACYP1A2
SCHEMBL16185152 0.87 SCN9A (0.42) TGFBR1MAP3K11KITKDM4EALDH1A1
SCHEMBL16184191 0.87 PDGFRB (0.39) TGFBR1MAP3K11KDM4EALDH1A1LMNA
SCHEMBL14474187 0.86 SCN9A (0.38) TGFBR1MAP3K11KITKDM4EALDH1A1

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 TGFBR1 4861/4885MAP3K11 914/4885KIT 3161/4885

“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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