SCHEMBL16183391

SCHEMBL16183391

Fc1ccc(-c2ccc3c(N4CCc5cc(Cl)ccc54)nc(-c4cccnc4)nc3c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 5/20 0.46
▸ GBA1 P04062 5/20 0.43
▸ CYP1A2 P05177 3/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ ALOX15 P16050 2/20 0.41
▸ CLK4 Q9HAZ1 2/20 0.41
▸ CYP11B1 P15538 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ GAA P10253 1/20 0.41
▸ PDE5A O76074 4/20 0.40
▸ TSHR P16473 2/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 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
SCHEMBL16183390 0.94 CYP11B2 (0.44) CYP11B2GBA1CYP1A2CYP3A4LMNA
SCHEMBL16183393 0.94 GBA1 (0.47) CYP11B2GBA1CYP1A2CYP3A4LMNA
SCHEMBL16183376 0.93 CYP11B2 (0.46) CYP11B2GBA1CYP1A2CYP3A4LMNA
SCHEMBL16183394 0.93 GBA1 (0.45) CYP11B2GBA1CYP1A2CYP3A4LMNA
SCHEMBL16183405 0.91 GBA1 (0.41) CYP11B2GBA1CYP1A2CYP3A4LMNA
SCHEMBL16183395 0.91 GBA1 (0.45) CYP11B2GBA1CYP1A2CYP3A4LMNA
SCHEMBL16183388 0.91 GBA1 (0.41) CYP11B2GBA1CYP1A2CYP3A4LMNA
SCHEMBL16183992 0.90 CYP11B2 (0.41) CYP11B2GBA1CYP1A2CYP3A4LMNA
SCHEMBL16183409 0.89 GBA1 (0.40) CYP11B2GBA1CYP1A2CYP3A4LMNA
SCHEMBL16183978 0.89 CYP11B2 (0.49) CYP11B2GBA1CYP1A2CYP3A4LMNA

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 CYP11B2 2204/4885GBA1 1316/4885CYP1A2 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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