SCHEMBL21474623

SCHEMBL21474623

Cc1nnn(Cc2ccccc2)c1C(=O)c1cc2c(s1)-c1ccc(F)cc1N(C(=O)c1ccc([N+](=O)[O-])cc1)CC2

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.36
ALDH1A1 P00352 2/20 0.36
AR P10275 1/20 0.35
STING1 Q86WV6 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
LMNA P02545 5/20 0.34
KCNK3 O14649 1/20 0.34
AVPR2 P30518 1/20 0.33
KDM4E B2RXH2 1/20 0.33
F2 P00734 1/20 0.33
RAB9A P51151 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL21474611 0.90 LMNA (0.36) MAPTALDH1A1LMNAKCNK3AVPR2
SCHEMBL20622238 0.80 NOTUM (0.41) MAPTALDH1A1STING1L3MBTL1LMNA
SCHEMBL21471605 0.80 SCD (0.31) ALDH1A1L3MBTL1KCNK3KDM4E
SCHEMBL20622251 0.78 L3MBTL1 (0.45) MAPTALDH1A1ARL3MBTL1LMNA
SCHEMBL21472051 0.76 AR (0.40) MAPTALDH1A1ARSTING1L3MBTL1
SCHEMBL21471613 0.76 NOTUM (0.32) ALDH1A1L3MBTL1LMNAKDM4EHTT
SCHEMBL21478310 0.76 STING1 (0.36) MAPTALDH1A1STING1L3MBTL1LMNA
SCHEMBL21472043 0.75 STING1 (0.36) MAPTALDH1A1STING1L3MBTL1LMNA
SCHEMBL20620169 0.74 HSD11B1 (0.40) MAPTALDH1A1STING1L3MBTL1LMNA
SCHEMBL20620103 0.72 AVPR2 (0.43) MAPTALDH1A1STING1L3MBTL1LMNA

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-10975094-B2 Heterocyclic compounds as RSV inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2021-04-13 US disclosed
US-20190315766-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. 2019-10-17 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-10975094-B2 Heterocyclic compounds as RSV inhibitors SIRT1, FURIN, SIRT5 MAPT 3526/4885ALDH1A1 701/4885AR 4319/4885
US-20190315766-A1 HETEROCYCLIC COMPOUNDS AS RSV INHIBITORS SIRT1, FURIN, SIRT5 MAPT 3526/4885ALDH1A1 701/4885AR 4319/4885

“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.