SCHEMBL21468543

SCHEMBL21468543

COc1c(NC(=O)O)ccc(CCCCCO)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 2/20 0.37
▸ CYP4A11 Q02928 3/20 0.37
▸ CYP4F2 P78329 2/20 0.37
▸ MEP1B Q16820 2/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ GFER P55789 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ CYP2C9 P11712 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ PGR P06401 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ TBXA2R P21731 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ AVPR2 P30518 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HTR2B P41595 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
SCHEMBL20234383 0.76 MEP1B (0.46) CYP4A11CYP4F2MEP1B
SCHEMBL21468519 0.75 KMT2A (0.39) METAP2MEP1BMEN1GFERKMT2A
SCHEMBL21468485 0.74 CYP2C9 (0.34) METAP2MEN1GFERKMT2ASMN1; SMN2
SCHEMBL24362372 0.69 MEP1B (0.48) MEP1BSMN1; SMN2MAPTMAPK1
SCHEMBL30548827 0.69 MEP1B (0.48) MEP1BSMN1; SMN2MAPTMAPK1
SCHEMBL20234381 0.68 MEP1B (0.50) MEP1BMEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL19234390 0.67 GABRA1 (0.41) CYP4A11CYP4F2PPARA
SCHEMBL21468471 0.66 RAB9A (0.43) CYP4A11CYP4F2PPARARAB9A
SCHEMBL31616466 0.66 CYP4F2 (0.38) CYP4A11CYP4F2CYP2C9LMNAPGR
SCHEMBL28111049 0.65 CYP4F2 (0.36) CYP4A11CYP4F2CYP2C9LMNAPGR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10450263-B2 Benzo annulenes as antiviral agents SOUTHERN RESEARCH INSTITUTE (US) 2019-10-22 — — 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-10450263-B2 Benzo annulenes as antiviral agents MAVS, ZC3HAV1, GABBR1 METAP2 3878/4885CYP4A11 3508/4885CYP4F2 3688/4885

“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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