SCHEMBL20798296

SCHEMBL20798296

CC(C)(C)[Si](C)(C)Oc1ccc2c(c1)CCC(Cc1ccc(N)cc1)C2=O

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 8/20 0.59
CYP24A1 Q07973 6/20 0.56
CYP19A1 P11511 5/20 0.56
CYP27A1 Q02318 3/20 0.47
ITGB3 P05106 1/20 0.42
ITGA2B P08514 1/20 0.42
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
HTR6 P50406 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
SCHEMBL30598686 1.00 CYP26A1 (0.59) CYP26A1CYP24A1CYP19A1CYP27A1ITGB3
SCHEMBL9419768 0.77 CA12 (0.43) CYP26A1CYP24A1CYP19A1CYP27A1THRA
SCHEMBL20809845 0.77 CYP26A1 (0.47) CYP26A1CYP24A1CYP19A1CYP27A1ITGB3
SCHEMBL10450802 0.74 CA12 (0.43) CYP26A1CYP24A1CYP19A1CYP27A1THRA
SCHEMBL7245357 0.73 CYP24A1 (0.80) CYP26A1CYP24A1CYP19A1CYP27A1
SCHEMBL6827615 0.72 CYP19A1 (1.00) CYP26A1CYP24A1CYP19A1CYP27A1
SCHEMBL8159828 0.72 CYP26A1 (0.78) CYP26A1CYP24A1CYP19A1CYP27A1
SCHEMBL6113027 0.71 MAOB (0.50)
SCHEMBL8203668 0.70 CYP26A1 (0.79) CYP26A1CYP24A1CYP19A1CYP27A1ITGB3
SCHEMBL24529065 0.70 MAOB (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111183130-B Benzoheterocycle derivatives and pharmaceutical compositions containing the same 恒翼生物医药(上海)股份有限公司 2023-10-20 CN disclosed
US-11091421-B2 Benzene fused heterocyclic derivative and pharmaceutical composition comprising the same TAIWANJ PHARMACEUTICALS CO., LTD. (TW) 2021-08-17 US disclosed
US-11091421-B2 Benzene fused heterocyclic derivative and pharmaceutical composition comprising the same TAIWANJ PHARMACEUTICALS CO., LTD. (TW) 2021-08-17 US disclosed
EP-3679012-A1 BENZENE FUSED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Taiwanj Pharmaceuticals Co., Ltd. (TW) 2020-07-15 EP disclosed
US-20200190010-A1 BENZENE FUSED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME TAIWANJ PHARMACEUTICALS CO., LTD. (TW) 2020-06-18 US disclosed
US-20200190010-A1 BENZENE FUSED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME TAIWANJ PHARMACEUTICALS CO., LTD. (TW) 2020-06-18 US disclosed
CN-111183130-A Benzoheterocyclic derivatives and pharmaceutical compositions containing the same 景凱生物科技股份有限公司 2020-05-19 CN disclosed
WO-2019051222-A1 BENZENE FUSED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME TAIWANJ PHARMACEUTICALS CO., LTD. (TW) 2019-03-14 WO disclosed
WO-2019051222-A1 BENZENE FUSED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME TAIWANJ PHARMACEUTICALS CO., LTD. (TW) 2019-03-14 WO 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-11091421-B2 Benzene fused heterocyclic derivative and pharmaceutical composition comprising the same RORB, RORC, NR3C1 CYP26A1 418/4885CYP24A1 262/4885CYP19A1 224/4885
US-20200190010-A1 BENZENE FUSED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME RORB, RORC, NR3C1 CYP26A1 418/4885CYP24A1 262/4885CYP19A1 224/4885

“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.