SCHEMBL16184207

SCHEMBL16184207

CNc1nc(-c2cnccn2)nc2c(OC)cc(-c3cccc(Cl)c3)cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 1/20 0.43
▸ PDE4B Q07343 2/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ TNF P01375 1/20 0.38
▸ MAT2A P31153 1/20 0.38
▸ ROCK2 O75116 1/20 0.37
▸ ROCK1 Q13464 1/20 0.37
▸ TSHR P16473 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ TGFBR1 P36897 2/20 0.36
▸ PPP1CA P62136 2/20 0.36
▸ FYN P06241 1/20 0.36
▸ ABL1 P00519 1/20 0.35
▸ BCR P11274 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ ABCG2 Q9UNQ0 1/20 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
SCHEMBL16184225 0.91 LIMK1 (0.35) TNFMAT2AROCK2NPC1KMT2A
SCHEMBL16184206 0.89 KIT (0.40) TSHRNPC1SMN1; SMN2ALDH1A1PTGER2
SCHEMBL16184196 0.89 CYP1A2 (0.47) ROCK2TSHRMAPTNPC1SMN1; SMN2
SCHEMBL16184202 0.89 NPC1 (0.41) TNFMAT2AROCK2TSHRNPC1
SCHEMBL16184203 0.89 CYP1A2 (0.42) TSHRNPC1SMN1; SMN2KMT2AMEN1
SCHEMBL16184183 0.89 KIT (0.41) MAP4K4PDE4BROCK2ROCK1TGFBR1
SCHEMBL16184217 0.87 PDGFRB (0.39) NPC1ALDH1A1CYP19A1CYP11B1CYP11B2
SCHEMBL16184370 0.87 MAP4K4 (0.45) MAP4K4MAT2AMAPTNPC1KMT2A
SCHEMBL16183618 0.87 CYP1A2 (0.48) MAP4K4PDE4BPDE4DTSHRMAPT
SCHEMBL16184228 0.86 LIMK1 (0.39) TNFMAT2ANPC1SMN1; SMN2KMT2A

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 MAP4K4 635/4885PDE4B 336/4885PDE4D 439/4885

“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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