SCHEMBL23090376

SCHEMBL23090376

COc1cc2c(cc1C(=O)Nc1cc(C)n(C(C)(C)C)n1)CCCCC2

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 5/20 0.55
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ MAP3K5 Q99683 11/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39

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
SCHEMBL23090414 0.83 DHODH (0.50) DHODHLMNASMN1; SMN2MEN1RAB9A
SCHEMBL21499347 0.78 DHODH (0.56) DHODHLMNASMN1; SMN2MEN1RAB9A
SCHEMBL23090375 0.75 DHODH (0.59) DHODHLMNASMN1; SMN2MEN1RAB9A
SCHEMBL23090396 0.74 DHODH (0.53) DHODHLMNASMN1; SMN2MEN1RAB9A
SCHEMBL23090412 0.74 DHODH (0.71) DHODHLMNASMN1; SMN2MEN1RAB9A
SCHEMBL23090382 0.71 DHODH (1.00) DHODHLMNASMN1; SMN2MEN1RAB9A
SCHEMBL23090367 0.70 DHODH (1.00) DHODHLMNASMN1; SMN2MEN1RAB9A
SCHEMBL23090394 0.70 DHODH (0.58) DHODHLMNASMN1; SMN2MEN1RAB9A
SCHEMBL23090368 0.67 DHODH (0.53) DHODHLMNASMN1; SMN2MEN1RAB9A
SCHEMBL23090366 0.67 DHODH (0.57) DHODHLMNASMN1; SMN2MEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11066357-B2 Benzoannulene derivatives as antiviral agents SOUTHERN RESEARCH INSTITUTE (US) 2021-07-20 — — US disclosed
US-11066357-B2 Benzoannulene derivatives as antiviral agents SOUTHERN RESEARCH INSTITUTE (US) 2021-07-20 — — US disclosed
US-20210078937-A1 BENZOANNULENE DERIVATIVES AS ANTIVIRAL AGENTS SOUTHERN RESEARCH INSTITUTE 2021-03-18 — — US disclosed
US-20210078937-A1 BENZOANNULENE DERIVATIVES AS ANTIVIRAL AGENTS SOUTHERN RESEARCH INSTITUTE 2021-03-18 — — 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-20210078937-A1 BENZOANNULENE DERIVATIVES AS ANTIVIRAL AGENTS ZC3HAV1, MAVS, ZC3HAV1L DHODH 344/4885LMNA 3202/4885SMN1; SMN2 1489/4885
US-11066357-B2 Benzoannulene derivatives as antiviral agents ZC3HAV1, MAVS, ZC3HAV1L DHODH 344/4885LMNA 3202/4885SMN1; SMN2 1489/4885

“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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