SCHEMBL16184209

SCHEMBL16184209

CNc1nc(-c2cnccn2)nc2c(OC)cc(-c3cccc(Cl)c3Cl)cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.37
▸ EPHB4 P54760 1/20 0.35
▸ CYP1A2 P05177 3/20 0.35
▸ CYP3A4 P08684 3/20 0.35
▸ CYP2D6 P10635 3/20 0.35
▸ MAPK1 P28482 3/20 0.35
▸ CYP2C19 P33261 3/20 0.35
▸ HSD17B10 Q99714 3/20 0.35
▸ TDP1 Q9NUW8 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ P2RX7 Q99572 1/20 0.35
▸ CYP2C9 P11712 1/20 0.34
▸ DYRK1A Q13627 2/20 0.34
▸ LIMK1 P53667 5/20 0.34
▸ LIMK2 P53671 5/20 0.34

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
SCHEMBL16184201 0.93 CYP1A2 (0.40) PTPN1CYP1A2CYP3A4CYP2D6MAPK1
SCHEMBL16184228 0.87 LIMK1 (0.39) PTPN1MAPK1ALDH1A1SMN1; SMN2HPGD
SCHEMBL16184224 0.86 LIMK1 (0.38) PTPN1LIMK1LIMK2MAT2A
SCHEMBL16184205 0.86 CYP3A4 (0.41) PTPN1CYP1A2CYP3A4CYP2D6MAPK1
SCHEMBL14474673 0.85 LMNA (0.38) CYP1A2CYP3A4CYP2D6MAPK1CYP2C19
SCHEMBL16184182 0.85 CYP1A2 (0.41) PTPN1CYP1A2CYP3A4CYP2D6MAPK1
SCHEMBL16184207 0.85 MAP4K4 (0.43) CYP1A2CYP3A4CYP2D6CYP2C19HSD17B10
SCHEMBL16184217 0.84 PDGFRB (0.39) CYP1A2CYP3A4CYP2D6MAPK1CYP2C19
SCHEMBL16184202 0.84 NPC1 (0.41) CYP1A2CYP3A4CYP2D6MAPK1CYP2C19
SCHEMBL16184225 0.83 LIMK1 (0.35) LIMK1LIMK2METAP2METAP1EDNRB

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 PTPN1 78/4885EPHB4 1761/4885CYP1A2 2971/4885

“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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