SCHEMBL350132

SCHEMBL350132

CC[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 2/20 0.55
GRIN2B Q13224 2/20 0.55
CYP19A1 P11511 1/20 0.52
GPBAR1 Q8TDU6 3/20 0.51
LMNA P02545 3/20 0.51
EPHA2 P29317 2/20 0.51
HSD17B10 Q99714 2/20 0.51
AKR1B10 O60218 1/20 0.51
AKR1B1 P15121 1/20 0.51
EFNA1 P20827 1/20 0.51
PSEN1 P49768 1/20 0.51
PSEN2 P49810 1/20 0.51
APH1B Q8WW43 1/20 0.51
NCSTN Q92542 1/20 0.51
APH1A Q96BI3 1/20 0.51
PSENEN Q9NZ42 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
SHBG P04278 1/20 0.42

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
SCHEMBL20677083 1.00 GRIN1 (0.55) GRIN1GRIN2BCYP19A1GPBAR1LMNA
SCHEMBL29875956 1.00 GRIN1 (0.55) GRIN1GRIN2BCYP19A1GPBAR1LMNA
SCHEMBL28175592 1.00 GRIN1 (0.55) GRIN1GRIN2BCYP19A1GPBAR1LMNA
SCHEMBL19313988 1.00 GRIN1 (0.55) GRIN1GRIN2BCYP19A1GPBAR1LMNA
SCHEMBL144721 1.00 GRIN1 (0.55) GRIN1GRIN2BCYP19A1GPBAR1LMNA
SCHEMBL144720 1.00 GRIN1 (0.55) GRIN1GRIN2BCYP19A1GPBAR1LMNA
Bromide SCHEMBL16178922 0.98 GRIN1 (0.54) GRIN1GRIN2BCYP19A1GPBAR1LMNA
Bromide SCHEMBL16178917 0.98 GRIN1 (0.54) GRIN1GRIN2BCYP19A1GPBAR1LMNA
Charcoal, Activated SCHEMBL30693761 0.98 GRIN1 (0.54) GRIN1GRIN2BCYP19A1GPBAR1LMNA
Water SCHEMBL28180475 0.98 GRIN1 (0.54) GRIN1GRIN2BCYP19A1GPBAR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3321686-B1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME METABOLON INC (US) 2024-03-13 EP claimed
EP-3965773-A1 NOVEL METHOD FOR SYNTHESIZING 25-OH CHOLESTEROL/CALCIFEDIOL FROM PHYTOSTEROL Fermenta Biotech Limited (IN) 2022-03-16 EP claimed
EP-3321686-A1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME Metabolon, Inc. (US) 2018-05-16 EP claimed
EP-2951313-B1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME METABOLON INC (US) 2018-03-07 EP claimed
US-9910047-B2 Biomarkers related to insulin resistance progression and methods using the same METABOLON, INC. (US) 2018-03-06 US claimed
CN-106231908-A System for pest extermination, inhibition or control 埃梅卡泰克有限责任公司 2016-12-14 CN claimed
US-20150362510-A1 Biomarkers Related to Insulin Resistance Progression and Methods Using the Same METABOLON, INC. 2015-12-17 US claimed
EP-2667876-A2 METHODS AND COMPOUNDS FOR PREPARING 3ALPHA-OXYGEN SUBSTITUTED STEROIDS Harbor BioSciences, Inc. (US) 2013-12-04 EP claimed
EP-1812009-B1 GABA-STEROID ANTAGONISTS AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS UMECRINE AB (SE) 2013-05-15 EP claimed
WO-2012083090-A2 METHODS AND COMPOUNDS FOR PREPARING 3ALPHA-OXYGEN SUBSTITUTED STEROIDS HARBOR BIOSCIENCES, INC. (US) 2012-06-21 WO claimed
EP-1082319-B1 BENZOCARBAZOLE AND INDENOINDOLE DERIVED ESTROGENIC AGENTS WYETH CORP (US) 2006-09-13 EP claimed
WO-2004093891-A1 VEGETABLE EXTRACT COMPOSITIONS COMPRISING INODOLE ACETIC, METHODS FOR THE PREPARATION OF SAID COMPSITIONS, AND THEIR USE AS CELL GROWTH INHIBITING AGENTS VEIJLEN N.V. (AN) 2004-11-04 WO claimed
EP-1082319-A1 BENZOCARBAZOL AND INDENOINOLE DERIVED ESTROGENIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 2001-03-14 EP claimed
US-6159959-A Combined estrogen and antiestrogen therapy AMERICAN HOME PRODUCTS CORPORATION (US) 2000-12-12 US claimed
WO-1999058524-A1 BENZOCARBAZOLE AND INDENOINDOLE DERIVED ESTROGENIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-11-18 WO claimed
US-20250313905-A1 METHODS AND COMPOSITIONS FOR IMPROVED PSYCHOLOGICAL AND RESILIENCE MEASURES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-10-09 US disclosed
US-20250213591-A1 NEUROACTIVE STEROIDS, COMPOSITIONS, AND USES THEREOF SAGE THERAPEUTICS, INC. 2025-07-03 US disclosed
EP-0527962-A4 METHOD, COMPOSITIONS, AND COMPOUNDS FOR MODULATING BRAIN EXCITABILITY 1993-10-20 EP disclosed
EP-0527962-A1 METHOD, COMPOSITIONS, AND COMPOUNDS FOR MODULATING BRAIN EXCITABILITY GEE, Kelvin W. (US) 1993-02-24 EP disclosed
WO-1991016897-A1 METHOD, COMPOSITIONS, AND COMPOUNDS FOR MODULATING BRAIN EXCITABILITY WELLMAN GEE KELVIN (US) 1991-11-14 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 (1 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-20250213591-A1 NEUROACTIVE STEROIDS, COMPOSITIONS, AND USES THEREOF GAP43, HSD3B1, CYP17A1 GRIN1 133/4885GRIN2B 134/4885CYP19A1 59/4885

“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.