SCHEMBL14475260

SCHEMBL14475260

CCOc1cc(-c2ccccc2F)cc2c(NC)nc(-c3ccccn3)nc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 4/20 0.42
▸ S1PR1 P21453 1/20 0.42
▸ MAPK14 Q16539 2/20 0.41
▸ FFAR1 O14842 6/20 0.40
▸ METAP2 P50579 1/20 0.40
▸ METAP1 P53582 1/20 0.40
▸ KDM4E B2RXH2 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ NPC1 O15118 2/20 0.36

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
SCHEMBL14474689 0.93 FFAR1 (0.43) GRM5S1PR1MAPK14FFAR1METAP2
SCHEMBL16185147 0.92 FFAR1 (0.43) GRM5S1PR1MAPK14FFAR1METAP2
SCHEMBL16185154 0.92 GRM5 (0.42) GRM5S1PR1MAPK14FFAR1METAP2
SCHEMBL16185127 0.91 KDM4E (0.37) GRM5S1PR1KDM4ELMNASMN1; SMN2
SCHEMBL16185123 0.90 LMNA (0.46) GRM5FFAR1METAP2METAP1KDM4E
SCHEMBL14475257 0.90 GRM5 (0.35) GRM5S1PR1MAPK14FFAR1KDM4E
SCHEMBL14475264 0.90 PIM1 (0.36) GRM5S1PR1MAPK14KDM4ELMNA
SCHEMBL14475269 0.90 KDM4E (0.35) GRM5S1PR1MAPK14KDM4ELMNA
SCHEMBL14474198 0.88 S1PR1 (0.46) GRM5S1PR1MAPK14FFAR1METAP2
SCHEMBL16185164 0.88 GRM5 (0.43) GRM5S1PR1MAPK14FFAR1METAP2

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 3 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
WO-2013003586-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-03 — — WO 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 GRM5 37/4885S1PR1 3969/4885MAPK14 2173/4885

“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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