SCHEMBL16183288

SCHEMBL16183288

Cc1c(-c2cc(F)cc(F)c2)ccc2nc(-c3cccnc3)nc(N)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 4/20 0.40
▸ CYP11B2 P19099 4/20 0.40
▸ ABCG2 Q9UNQ0 3/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ PDE5A O76074 3/20 0.40
▸ POLB P06746 2/20 0.40
▸ KDM4E B2RXH2 5/20 0.39
▸ HPGD P15428 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP2D6 P10635 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
SCHEMBL16183286 0.87 CHRNB2 (0.47) CYP11B1CYP11B2ABCG2SMN1; SMN2PDE5A
SCHEMBL16183287 0.81 CHRNB2 (0.49) CYP11B1CYP11B2ABCG2KDM4EHPGD
SCHEMBL16186207 0.80 CYP11B2 (0.48) CYP11B1CYP11B2ABCG2KDM4EHPGD
SCHEMBL14474553 0.78 ABCG2 (0.52) ABCG2PDE5APOLBKDM4EHPGD
SCHEMBL18023013 0.78 GBA1 (0.48) CYP11B1CYP11B2ABCG2PDE5ACYP1A2
SCHEMBL14731283 0.77 PDE5A (0.40) CYP11B1CYP11B2ABCG2SMN1; SMN2PDE5A
SCHEMBL19204123 0.76 CYP11B1 (0.42) CYP11B1CYP11B2ABCG2SMN1; SMN2PDE5A
SCHEMBL16184290 0.76 CYP1A2 (0.52) ABCG2PDE5APOLBKDM4EHPGD
SCHEMBL14474620 0.76 PDE5A (0.43) CYP11B1CYP11B2ABCG2PDE5APOLB
SCHEMBL14474504 0.75 CYP1A2 (0.53) CYP11B1CYP11B2ABCG2PDE5APOLB

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 CYP11B1 2235/4885CYP11B2 2204/4885ABCG2 1597/4885

“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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