SCHEMBL21024549

SCHEMBL21024549

O=C1Nc2ccccc2C(c2ccccc2)=C[C@@H]1Nc1nnc(-c2ncc(Br)cc2N2CCOCC2)o1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FPR1 P21462 1/20 0.34
▸ FPR2 P25090 1/20 0.34
▸ PRKDC P78527 3/20 0.33
▸ CBLB Q13191 8/20 0.33
▸ ATR Q13535 1/20 0.32
▸ DDB1 Q16531 1/20 0.32
▸ CRBN Q96SW2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ GRIA1 P42261 1/20 0.32
▸ BRD4 O60885 2/20 0.32
▸ CREBBP Q92793 2/20 0.32
▸ LRRK2 Q5S007 1/20 0.31
▸ IDH1 O75874 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
SCHEMBL21024564 0.90 DDB1 (0.34) FPR1FPR2PRKDCCBLBATR
SCHEMBL21024574 0.90 LRRK2 (0.35) FPR1FPR2PRKDCCBLBALDH1A1
SCHEMBL21024548 0.90 FPR1 (0.34) FPR1FPR2PRKDCCBLBALDH1A1
SCHEMBL21024568 0.90 FPR1 (0.32) FPR1FPR2PRKDCCBLBATR
SCHEMBL21024562 0.89 DDB1 (0.33) FPR1FPR2PRKDCCBLBATR
SCHEMBL24611907 0.86 CBLB (0.45) CBLB
SCHEMBL20098467 0.86 CBLB (0.45) CBLB
SCHEMBL21024547 0.82 KDM4E (0.38) FPR1FPR2CBLBALDH1A1KMT2A
SCHEMBL21024652 0.80 FPR2 (0.39) FPR1FPR2PRKDCCBLBALDH1A1
SCHEMBL20985129 0.80 PRKDC (0.34) FPR1FPR2PRKDCCBLBALDH1A1

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 FPR1 244/4885FPR2 329/4885PRKDC 4864/4885
US-10647711-B2 Azepin-2-one derivatives as RSV inhibitors AZI2, FURIN, ACE2 FPR1 244/4885FPR2 329/4885PRKDC 4864/4885

“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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