SCHEMBL118654

SCHEMBL118654

CC(C)(C)OC(=O)N1CCC2(CCNCC2)CC1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.50
USP2 O75604 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
GABRD O14764 2/20 0.47
GABRA1 P14867 2/20 0.47
GABRB1 P18505 2/20 0.47
GABRA5 P31644 2/20 0.47
GABRA3 P34903 2/20 0.47
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
GABRA4 P48169 2/20 0.47
GPR119 Q8TDV5 3/20 0.44
CYP2D6 P10635 1/20 0.42
ACACB O00763 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
Hydrochloric Acid SCHEMBL2075849 0.98 CYP1A2 (0.49) CYP1A2USP2SMN1; SMN2GABRDGABRA1
SCHEMBL485158 0.94 CYP1A2 (0.49) CYP1A2USP2SMN1; SMN2GABRDGABRA1
Trifluoroacetic Acid SCHEMBL15571773 0.93 CYP1A2 (0.44) CYP1A2USP2SMN1; SMN2GABRDGABRA1
SCHEMBL484311 0.90 CYP11B2 (0.49) CYP1A2USP2SMN1; SMN2GABRDGABRA1
SCHEMBL484585 0.90 USP2 (0.46) CYP1A2USP2SMN1; SMN2GPR119ACACB
Hydrochloric Acid SCHEMBL349978 0.89 CYP11B2 (0.48) CYP1A2USP2SMN1; SMN2GABRDGABRA1
Hydrochloric Acid SCHEMBL896891 0.89 USP2 (0.45) CYP1A2USP2SMN1; SMN2GPR119ACACB
SCHEMBL346995 0.88 USP2 (0.56) CYP1A2USP2SMN1; SMN2GPR119CYP2D6
Oxalic Acid SCHEMBL31368523 0.86 CYP11B2 (0.46) CYP1A2USP2SMN1; SMN2GABRDGABRA1
SCHEMBL2870337 0.85 L3MBTL3 (0.44) CYP1A2USP2SMN1; SMN2GABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119661529-A Synthesis method of 3, 9-diazaspiro [5.5] undecane-3-tert-butyl formate 上海馨远医药科技有限公司 2025-03-21 CN claimed
US-20250066325-A1 DIRECTED DEGRON MOLECULES AND APPLICATIONS THEREOF THE BROAD INSTITUTE, INC. 2025-02-27 US claimed
EP-4426687-A1 DIRECTED DEGRON MOLECULES AND APPLICATIONS THEREOF The Brigham & Women's Hospital, Inc. (US) 2024-09-11 EP claimed
WO-2023081400-A9 DIRECTED DEGRON MOLECULES AND APPLICATIONS THEREOF THE BRIGHAM AND WOMEN’S HOSPITAL, INC. (US) 2023-06-01 WO claimed
WO-2023081400-A1 DIRECTED DEGRON MOLECULES AND APPLICATIONS THEREOF THE BRIGHAM AND WOMEN’S HOSPITAL, INC. (US) 2023-05-11 WO claimed
JP-4726238-B2 2011-07-20 JP claimed
WO-2008100564-A1 LTA4H MODULATORS AND USES THEROF JANSSEN PHARMACEUTICA N.V. (BE) 2008-08-21 WO claimed
EP-1660492-B1 BENZIMIDAZOLE, BENZTHIAZOLE AND BENZOXAZOLE DERIVATIVES AND THEIR USE AS LTA4H MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2008-08-20 EP claimed
US-20080194630-A1 Leukotriene A-4 hydrolase inhibitors; antiinflammatory agents; skin disorders; analgesics; stroke; anticancer agents; antiallergens; rhinitis;cystic fibrosis;sepsis JANSSEN PHARMACEUTICA N.V. (BE) 2008-08-14 US claimed
EP-1660491-B1 BENZIMIDAZOLE, BENZTHIAZOLE AND BENZOXAZOLE DERIVATIVES AND THEIR USE AS LTA4H MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2008-08-06 EP claimed
EP-1868605-A2 PHENYL AND PYRIDYL LTA4H MODULATORS Janssen Pharmaceutica, N.V. (BE) 2007-12-26 EP claimed
WO-2005012297-A9 BENZIMIDAZOLE, BENZTHIAZOLE AND BENZOXAZOLE DERIVATIVES AND THEIR USE AS LTA4H MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2007-01-04 WO claimed
WO-2006105304-A2 PHENYL AND PYRIDYL LTA4H MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-10-05 WO claimed
US-20060223792-A1 Phenyl and pyridyl LTA4H modulators JANSSEN PHARMACEUTICA N.V. (BE) 2006-10-05 US claimed
EP-1660492-A1 BENZIMIDAZOLE, BENZTHIAZOLE AND BENZOXAZOLE DERIVATIVES AND THEIR USE AS LTA4H MODULATORS Janssen Pharmaceutica N.V. (BE) 2006-05-31 EP claimed
EP-1660491-A1 BENZIMIDAZOLE, BENZTHIAZOLE AND BENZOXAZOLE DERIVATIVES AND THEIR USE AS LTA4H MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-05-31 EP claimed
US-20050043379-A1 LTA4H Modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-02-24 US claimed
US-20050043378-A1 Leukotriene hydrolases inhibitors; antiinflamamtory agents; inflamamtory bowel disorders; antihistamines; chronic obstructive pulmonary diseases; multiple sclerosis; antiarthritic agents JANSSEN PHARMACEUTICA, N.V. (BE) 2005-02-24 US claimed
WO-2005012297-A1 BENZIMIDAZOLE, BENZTHIAZOLE AND BENZOXAZOLE DERIVATIVES AND THEIR USE AS LTA4H MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-10 WO claimed
WO-2005012296-A1 BENZIMIDAZOLE, BENZTHIAZOLE AND BENZOXAZOLE DERIVATIVES AND THEIR USE AS LTA4H MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-10 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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-20060223792-A1 Phenyl and pyridyl LTA4H modulators LTA4H, LTB4R, LTC4S CYP1A2 682/4885USP2 1831/4885SMN1; SMN2 4712/4885
US-20080194630-A1 Leukotriene A-4 hydrolase inhibitors; antiinflammatory agents; skin disorders; analgesics; stroke; anticancer agents; antiallergens; rhinitis;cystic fibrosis;sepsis LTA4H, LTC4S, LTB4R CYP1A2 1031/4885USP2 3308/4885SMN1; SMN2 2349/4885
US-20050043378-A1 Leukotriene hydrolases inhibitors; antiinflamamtory agents; inflamamtory bowel disorders; antihistamines; chronic obstructive pulmonary diseases; multiple sclerosis; antiarthritic agents LTA4H, LTC4S, LTB4R CYP1A2 2109/4885USP2 642/4885SMN1; SMN2 4268/4885
US-20250066325-A1 DIRECTED DEGRON MOLECULES AND APPLICATIONS THEREOF FKBP14, FKBP3, FKBP2 CYP1A2 4336/4885USP2 618/4885SMN1; SMN2 4071/4885
US-20050043379-A1 LTA4H Modulators LTA4H, LTB4R, LTB4R2 CYP1A2 1019/4885USP2 1794/4885SMN1; SMN2 4666/4885

“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.