SCHEMBL21499331

SCHEMBL21499331

COc1cc2c(cc1NC(=O)c1cnc(F)cc1F)CCCCN2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ ALDH1A1 P00352 3/20 0.45
▸ MAPT P10636 5/20 0.41
▸ DHODH Q02127 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.36
▸ KDM4C Q9H3R0 2/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.35

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
SCHEMBL21499334 0.87 LMNA (0.65) LMNASMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21499379 0.79 RAB9A (0.49) LMNASMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21499365 0.79 HTT (0.48) LMNASMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21499332 0.79 LMNA (0.58) LMNASMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21499327 0.77 MAPT (0.53) LMNASMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21499392 0.77 MAPT (0.53) LMNASMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21499368 0.76 ALDH1A1 (0.59) LMNASMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21499383 0.75 LMNA (0.55) LMNASMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21499312 0.75 MAPT (0.58) LMNASMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21499328 0.75 MAPT (0.61) LMNASMN1; SMN2RAB9AKMT2AMEN1

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 LMNA 3559/4885SMN1; SMN2 804/4885RAB9A 1314/4885

“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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