SCHEMBL1886266

SCHEMBL1886266

COc1ccccc1-n1ccnc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 2/20 0.67
▸ CYP11B1 P15538 1/20 0.67
▸ CYP11B2 P19099 1/20 0.67
▸ IDO1 P14902 1/20 0.56
▸ CYP3A4 P08684 6/20 0.54
▸ CYP1A2 P05177 5/20 0.54
▸ CYP2D6 P10635 5/20 0.54
▸ CYP2C19 P33261 5/20 0.54
▸ TDP1 Q9NUW8 3/20 0.54
▸ LMNA P02545 3/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.52
▸ TSHR P16473 1/20 0.52
▸ CLK4 Q9HAZ1 1/20 0.52
▸ CYP2C9 P11712 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ MAPK1 P28482 1/20 0.51

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
SCHEMBL31149024 1.00 CYP19A1 (0.67) CYP19A1CYP11B1CYP11B2IDO1CYP3A4
SCHEMBL1882925 0.81 IDO1 (0.51) CYP19A1CYP11B1CYP11B2IDO1CYP3A4
SCHEMBL31408101 0.80 IDO1 (0.73) CYP19A1CYP11B1CYP11B2IDO1CYP3A4
SCHEMBL16382293 0.80 IDO1 (0.73) CYP19A1CYP11B1CYP11B2IDO1CYP3A4
SCHEMBL14121261 0.80 CYP11B1 (0.60) CYP19A1CYP11B1CYP11B2IDO1CYP3A4
SCHEMBL4508354 0.80 CYP11B1 (1.00) CYP19A1CYP11B1CYP11B2IDO1CYP3A4
SCHEMBL31589030 0.80 CYP19A1 (0.55) CYP19A1CYP11B1CYP11B2IDO1CYP3A4
SCHEMBL5511363 0.79 IDO1 (0.53) CYP19A1CYP11B1CYP11B2IDO1CYP3A4
SCHEMBL11701714 0.79 CYP19A1 (0.51) CYP19A1CYP11B1CYP11B2CYP3A4CYP1A2
Hydrochloric Acid SCHEMBL17583816 0.79 CYP19A1 (0.54) CYP19A1CYP11B1CYP11B2IDO1CYP3A4

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 58 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12227495-B2 Herbicidal compounds SYNGENTA CROP PROTECTION AG (CH) 2025-02-18 — — US disclosed
EP-3877378-B1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-12-21 — — EP disclosed
EP-3877378-B1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-12-21 — — EP disclosed
US-20210387976-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-12-16 — — US disclosed
US-20210387976-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-12-16 — — US disclosed
EP-3877378-A1 HERBICIDAL COMPOUNDS Syngenta Crop Protection AG (CH) 2021-09-15 — — EP disclosed
CN-112996780-A Herbicidal compounds 先正达农作物保护股份公司 2021-06-18 — — CN disclosed
CN-106699771-A Cryptotanshinone compound, as well as preparation method and application thereof 常州大学 2017-05-24 — — CN disclosed
EP-2951188-B1 PHOSPHORUS LIGANDS AND METHOD FOR THE SELECTIVE RUTHENIUM-CATALYZED HYDROAMINOMETHYLATION OF OLEFINS EVONIK DEGUSSA GMBH (DE) 2017-05-10 — — EP disclosed
EP-2254871-B1 SALTS COMPRISING ARYL-ALKYL-SUBSTITUTED IMIDAZOLIUM AND TRIAZOLIUM CATIONS AS IONIC FLUIDS UNIV DRESDEN TECH (DE) 2016-11-09 — — EP disclosed
US-20030191156-A1 Beta3 adrenergic agonists JPMORGAN CHASE BANK, N.A., AS SUCCESSOR COLLATERAL AGENT 2003-10-09 — — US disclosed
EP-1171485-A1 PROCESS FOR PRODUCING POLYOLEFINS EASTMAN CHEMICAL COMPANY (US) 2002-01-16 — — EP disclosed
EP-1159316-A1 PROCESS FOR PRODUCING POLYETHYLENE EASTMAN CHEMICAL COMPANY (US) 2001-12-05 — — EP disclosed
EP-1159315-A1 PROCESS FOR PRODUCING POLYETHYLENE EASTMAN CHEMICAL COMPANY (US) 2001-12-05 — — EP disclosed
US-6130217-A ANTITUMOR PFIZER INC (US) 2000-10-10 — — US disclosed
WO-2000058372-A1 PROCESS FOR PRODUCING POLYOLEFINS EASTMAN CHEMICAL COMPANY (US) 2000-10-05 — — WO disclosed
WO-2000052069-A1 PROCESS FOR PRODUCING POLYETHYLENE EASTMAN CHEMICAL COMPANY (US) 2000-09-08 — — WO disclosed
WO-2000052068-A1 PROCESS FOR PRODUCING POLYETHYLENE EASTMAN CHEMICAL COMPANY (US) 2000-09-08 — — WO disclosed
WO-1994022846-A1 COMPOUNDS ENHANCING ANTITUMOR ACTIVITY OF OTHER CYTOTOXIC AGENTS PFIZER INC. (US) 1994-10-13 — — WO disclosed
US-4006243-A FUNGICIDE, BACTERICIDE, YEAST SCHERING AKTIENGESELLSCHAFT (DT) 1977-02-01 — — 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 (3 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-12227495-B2 Herbicidal compounds DDT, NQO2, NHERF1 CYP19A1 761/4885CYP11B1 820/4885CYP11B2 1150/4885
US-20030191156-A1 Beta3 adrenergic agonists ADRB3, ADRB1, ADRB2 CYP19A1 2013/4885CYP11B1 211/4885CYP11B2 194/4885
US-20210387976-A1 HERBICIDAL COMPOUNDS DDT, NQO2, NHERF1 CYP19A1 761/4885CYP11B1 820/4885CYP11B2 1150/4885

“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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