SCHEMBL4361013

SCHEMBL4361013

C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)C(O)CC[C@@H]12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 1.00
LMNA P02545 4/20 0.65
MAPT P10636 2/20 0.65
SHBG P04278 3/20 0.64
CYP3A4 P08684 3/20 0.64
HSD17B10 Q99714 3/20 0.61
NR3C1 P04150 2/20 0.61
PGR P06401 2/20 0.61
SERPINA6 P08185 2/20 0.61
AR P10275 2/20 0.61
TSHR P16473 2/20 0.61
SNCA P37840 2/20 0.61
CACNA1C Q13936 2/20 0.61
CYP51A1 Q16850 2/20 0.61
GPBAR1 Q8TDU6 2/20 0.61
SIGMAR1 Q99720 2/20 0.61
MAPK1 P28482 1/20 0.61
OR51E2 Q9H255 1/20 0.61

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
SCHEMBL12430769 1.00 CYP19A1 (1.00) CYP19A1LMNAMAPTSHBGCYP3A4
SCHEMBL11020843 1.00 CYP19A1 (1.00) CYP19A1LMNAMAPTSHBGCYP3A4
SCHEMBL13787743 1.00 CYP19A1 (1.00) CYP19A1LMNAMAPTSHBGCYP3A4
SCHEMBL13752636 1.00 CYP19A1 (1.00) CYP19A1LMNAMAPTSHBGCYP3A4
SCHEMBL4431797 1.00 CYP19A1 (1.00) CYP19A1LMNAMAPTSHBGCYP3A4
SCHEMBL15903 1.00 CYP19A1 (1.00) CYP19A1LMNAMAPTSHBGCYP3A4
SCHEMBL13001778 1.00 CYP19A1 (1.00) CYP19A1LMNAMAPTSHBGCYP3A4
Sulfuric Acid SCHEMBL15901696 0.95 CYP19A1 (0.91) CYP19A1LMNAMAPTSHBGCYP3A4
Diethylamine SCHEMBL8741602 0.92 CYP19A1 (0.85) CYP19A1LMNAMAPTSHBGCYP3A4
Propionic Acid SCHEMBL29224763 0.92 CYP19A1 (0.85) CYP19A1LMNAMAPTSHBGCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4101378-A ADDING A GLYCERIDE TO THE CULTURE MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1978-07-18 US claimed
US-4057469-A Process for the microbiological oxidation of steroids MITSUBISHI CHEMICAL INDUSTRIES LTD. (JA) 1977-11-08 US claimed
CN-110643667-B Biological dehydrogenation method of methyltestosterone C1,2 position 湖南新合新生物医药有限公司 2023-05-05 CN disclosed
CN-115052975-A P450 BM3 monooxygenase variants for C19-hydroxylation of steroids 拜耳公司 2022-09-13 CN disclosed
US-10370654-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. (US) 2019-08-06 US disclosed
US-20180320170-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2018-11-08 US disclosed
US-9944925-B2 Processes and host cells for genome, pathway, and biomolecular engineering ENEVOLV, INC. 2018-04-17 US disclosed
US-20160186168-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. 2016-06-30 US disclosed
EP-3027754-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING enEvolv, Inc. (US) 2016-06-08 EP disclosed
WO-2015017866-A1 PROCESSES AND HOST CELLS FOR GENOME, PATHWAY, AND BIOMOLECULAR ENGINEERING ENEVOLV, INC. (US) 2015-02-05 WO disclosed
US-20090285919-A1 Rice Bran Extracts for Inflammation and Methods of Use Thereof HALPERN, BARUCH 2009-11-19 US disclosed
US-4873233-A ANTICARCINOGENIC AGENTS FARMITALIA CARLO ERBA S.P.A. (IT) 1989-10-10 US disclosed
EP-0307135-A1 17-substituted androsta-1,4-dien-3-one derivatives FARMITALIA CARLO ERBA S.r.l. (IT) 1989-03-15 EP disclosed
US-4101378-A ADDING A GLYCERIDE TO THE CULTURE MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1978-07-18 US disclosed
US-4101378-A ADDING A GLYCERIDE TO THE CULTURE MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1978-07-18 US disclosed
US-4057469-A Process for the microbiological oxidation of steroids MITSUBISHI CHEMICAL INDUSTRIES LTD. (JA) 1977-11-08 US disclosed
US-4057469-A Process for the microbiological oxidation of steroids MITSUBISHI CHEMICAL INDUSTRIES LTD. (JA) 1977-11-08 US disclosed