SCHEMBL21024634

SCHEMBL21024634

CCCCCCCC(CCCC)C1CCN(C(C)=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GNAI3 P08754 7/20 0.42
▸ GNAO1 P09471 7/20 0.42
▸ GNAI1 P63096 7/20 0.42
▸ CA2 P00918 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ USP2 O75604 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ GPR84 Q9NQS5 3/20 0.37
▸ FFAR1 O14842 1/20 0.37

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
SCHEMBL24040182 0.98 GNAI3 (0.43) GNAI3GNAO1GNAI1KDM4EUSP2
SCHEMBL20372808 0.92 ALDH1A1 (0.39) GNAI3GNAO1GNAI1KDM4EUSP2
SCHEMBL24345186 0.89 GNAI3 (0.41) GNAI3GNAO1GNAI1GPR84FFAR1
SCHEMBL24398569 0.86 GPR84 (0.41) CA2GPR84FFAR1
SCHEMBL22363328 0.80 PIK3CD (0.41) GNAI3GNAO1GNAI1KDM4EUSP2
SCHEMBL26465066 0.78 GAA (0.46) GNAI3GNAO1GNAI1KDM4EALDH1A1
SCHEMBL20626619 0.78 DPP4 (0.41) —
SCHEMBL18946832 0.78 GNAI3 (0.49) GNAI3GNAO1GNAI1
SCHEMBL18946483 0.78 GNAI3 (0.49) GNAI3GNAO1GNAI1
SCHEMBL11990125 0.77 PIK3CD (0.42) KDM4E

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-10647711-B2 Azepin-2-one derivatives as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2020-05-12 — — US disclosed
US-20190152968-A1 AZEPIN-2-ONE DERIVATIVES AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. 2019-05-23 — — 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 (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-20190152968-A1 AZEPIN-2-ONE DERIVATIVES AS RSV INHIBITORS AZI2, FURIN, ACE2 GNAI3 2561/4885GNAO1 4255/4885GNAI1 1893/4885
US-10647711-B2 Azepin-2-one derivatives as RSV inhibitors AZI2, FURIN, ACE2 GNAI3 2561/4885GNAO1 4255/4885GNAI1 1893/4885

“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