SCHEMBL23090369

SCHEMBL23090369

COC(=O)Cc1cc2c(cc1OC)CCCCC2

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 1/20 0.53
▸ DHODH Q02127 4/20 0.44
▸ CYP3A4 P08684 2/20 0.44
▸ LMNA P02545 6/20 0.43
▸ SMN1; SMN2 Q16637 5/20 0.43
▸ HTT P42858 3/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.43
▸ MAPT P10636 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ RAB9A P51151 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL23090401 0.86 HSD17B10 (0.51) SLC2A1DHODHCYP3A4LMNASMN1; SMN2
SCHEMBL29420185 0.81 CYP3A4 (0.62) CYP3A4ALDH1A1HPGDKDM4E
SCHEMBL24650547 0.79 CYP3A4 (0.41) SLC2A1CYP3A4ALDH1A1MEN1KMT2A
SCHEMBL23090403 0.75 DHODH (0.67) DHODHLMNASMN1; SMN2HTTNPSR1
SCHEMBL13332559 0.74 HSD17B1 (0.51) SLC2A1CYP3A4MAPTALDH1A1HPGD
SCHEMBL23090381 0.74 KMT2A (0.42) SLC2A1SMN1; SMN2HTTNPSR1MEN1
SCHEMBL2399645 0.73 MTNR1A (0.49) CYP3A4LMNAHTTALDH1A1HPGD
SCHEMBL9370651 0.73 SLC2A1 (0.58) SLC2A1HTTNPSR1
SCHEMBL4673015 0.72 CYP3A4 (0.51) CYP3A4ALDH1A1HPGDMEN1KMT2A
SCHEMBL2094025 0.72 GAA (0.53) CYP3A4NPSR1MAPTALDH1A1CYP1A2

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 SLC2A1 3161/4885DHODH 344/4885CYP3A4 1900/4885
US-11066357-B2 Benzoannulene derivatives as antiviral agents ZC3HAV1, MAVS, ZC3HAV1L SLC2A1 3161/4885DHODH 344/4885CYP3A4 1900/4885

“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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