SCHEMBL16185134

SCHEMBL16185134

CCOc1cc(-c2cccc(F)c2)cc2c(NC)nc(-c3ccccn3)nc12

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 8/20 0.47
▸ GRM5 P41594 6/20 0.46
▸ S1PR1 P21453 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ METAP2 P50579 1/20 0.39
▸ METAP1 P53582 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ MAPK14 Q16539 2/20 0.39

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
SCHEMBL16185164 0.93 GRM5 (0.43) FFAR1GRM5S1PR1KDM4ELMNA
SCHEMBL14474198 0.91 S1PR1 (0.46) FFAR1GRM5S1PR1KDM4ELMNA
SCHEMBL16185130 0.90 ABCG2 (0.45) FFAR1GRM5KDM4ELMNAHTT
SCHEMBL16185138 0.90 GRM5 (0.48) FFAR1GRM5LMNAMAP4K4
SCHEMBL16185136 0.89 GRM5 (0.44) FFAR1GRM5LMNAMAP4K4
SCHEMBL16185137 0.89 GRM5 (0.46) FFAR1GRM5LMNAMAP4K4MAPK14
SCHEMBL14474191 0.89 GRM5 (0.44) FFAR1GRM5LMNAMAP4K4
SCHEMBL16185154 0.87 GRM5 (0.42) FFAR1GRM5S1PR1KDM4ELMNA
SCHEMBL16185147 0.87 FFAR1 (0.43) FFAR1GRM5S1PR1KDM4ELMNA
SCHEMBL14475260 0.85 GRM5 (0.42) FFAR1GRM5S1PR1KDM4ELMNA

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 FFAR1 4087/4885GRM5 37/4885S1PR1 3969/4885

“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