SCHEMBL20618201

SCHEMBL20618201

c1cnc2cc(-c3ccc4cc(-c5ccc6ccoc6n5)[nH]c4n3)[nH]c2c1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 4/20 0.40
▸ CCNB2 O95067 3/20 0.36
▸ CDK1 P06493 3/20 0.36
▸ CCNB1 P14635 3/20 0.36
▸ CDK5 Q00535 3/20 0.36
▸ CDK5R1 Q15078 3/20 0.36
▸ CCNB3 Q8WWL7 3/20 0.36
▸ CLK2 P49760 3/20 0.34
▸ CLK3 P49761 3/20 0.34
▸ DYRK1A Q13627 3/20 0.34
▸ DAO P14920 1/20 0.34
▸ ATAD2 Q6PL18 1/20 0.34
▸ RIPK1 Q13546 8/20 0.34
▸ CCNE1 P24864 1/20 0.34
▸ CDK2 P24941 1/20 0.34
▸ GSK3A P49840 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ ITK Q08881 1/20 0.31

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
SCHEMBL20622229 0.87 GSK3B (0.36) GSK3BCCNB2CDK1CCNB1CDK5
SCHEMBL21117175 0.84 RIPK1 (0.48) CCNB2CDK1CCNB1CCNB3CLK2
SCHEMBL22546457 0.74 AXL (0.46) GSK3BCCNB2CDK1CCNB1CDK5
SCHEMBL15279970 0.72 GSK3B (0.68) GSK3BCCNB2CDK1CCNB1CDK5
SCHEMBL24985762 0.68 CCNE1 (0.38) CCNB2CDK1CCNB1CCNB3CLK2
SCHEMBL24987967 0.66 CCNE1 (0.38) CCNB2CDK1CCNB1CCNB3CLK2
SCHEMBL27650322 0.66 DAO (0.44) GSK3BCCNB2CDK1CCNB1CDK5
SCHEMBL20252218 0.65 DAO (0.38) GSK3BCCNB2CDK1CCNB1CDK5
SCHEMBL6489332 0.65 CCNB2 (0.61) GSK3BCCNB2CDK1CCNB1CDK5
SCHEMBL18445034 0.63 DAO (0.47) GSK3BCCNB2CDK1CCNB1CDK5

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-10851115-B2 Heterocyclic compounds as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2020-12-01 — — US disclosed
US-20190002478-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. 2019-01-03 — — 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 (2 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-20190002478-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS SIRT1, FURIN, SIRT5 GSK3B 1579/4885CCNB2 1006/4885CDK1 248/4885
US-10851115-B2 Heterocyclic compounds as RSV inhibitors SIRT1, FURIN, SIRT5 GSK3B 1579/4885CCNB2 1006/4885CDK1 248/4885

“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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