SCHEMBL16184885

SCHEMBL16184885

CCOc1cc(-c2cccc(-c3ncco3)c2)cc2c(NC)nc(-c3cccnc3)nc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.46
▸ S1PR1 P21453 3/20 0.45
▸ CCNK O75909 1/20 0.43
▸ CDK12 Q9NYV4 1/20 0.43
▸ HSD17B10 Q99714 3/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ CLK4 Q9HAZ1 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ NPSR1 Q6W5P4 3/20 0.42
▸ MAPK1 P28482 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ GRM5 P41594 1/20 0.42
▸ NPC1 O15118 4/20 0.41
▸ SMN1; SMN2 Q16637 5/20 0.40
▸ RAB9A P51151 3/20 0.40

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
SCHEMBL16184834 0.91 HSD17B10 (0.43) MAPTS1PR1CCNKCDK12HSD17B10
SCHEMBL16184881 0.89 MAPT (0.45) MAPTS1PR1CCNKCDK12HSD17B10
SCHEMBL16184859 0.87 HSD17B10 (0.52) MAPTS1PR1HSD17B10CYP1A2CYP3A4
SCHEMBL14475652 0.85 GRM5 (0.48) MAPTS1PR1HSD17B10CYP1A2CYP3A4
SCHEMBL16184848 0.84 GRM5 (0.48) MAPTS1PR1HSD17B10CYP1A2CYP3A4
SCHEMBL16184896 0.84 HSD17B10 (0.49) MAPTS1PR1HSD17B10CYP1A2CYP3A4
SCHEMBL16184856 0.84 CYP1A2 (0.48) MAPTS1PR1HSD17B10CYP1A2CYP3A4
SCHEMBL16184869 0.84 CYP1A2 (0.45) MAPTS1PR1CCNKCDK12HSD17B10
SCHEMBL16184876 0.84 HSD17B10 (0.45) MAPTS1PR1HSD17B10CYP1A2CYP3A4
SCHEMBL16184849 0.84 MAPT (0.48) MAPTS1PR1HSD17B10CYP1A2CYP3A4

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 MAPT 509/4885S1PR1 3969/4885CCNK 3151/4885

“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.

Send feedback