SCHEMBL22462845

SCHEMBL22462845

CC(C)(C)OC(=O)N1CCC(Cc2ccc(C(F)(F)F)cc2-c2cnn(C(=O)OC(C)(C)C)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.43
GPR119 Q8TDV5 8/20 0.42
P2RY14 Q15391 1/20 0.42
ROCK2 O75116 1/20 0.42
RORC P51449 1/20 0.42
EPHX2 P34913 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
STS P08842 1/20 0.40
ENPP2 Q13822 1/20 0.40
SYK P43405 1/20 0.40
LIPE Q05469 1/20 0.40

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
SCHEMBL30272629 1.00 TGFBR1 (0.43) TGFBR1GPR119P2RY14ROCK2RORC
SCHEMBL22462822 0.95 ROCK2 (0.41) TGFBR1GPR119P2RY14ROCK2RORC
SCHEMBL31071538 0.81 TGFBR1 (0.51) TGFBR1GPR119P2RY14RORCEPHX2
SCHEMBL23149167 0.80 EPHX2 (0.57) TGFBR1GPR119P2RY14RORCEPHX2
SCHEMBL28540034 0.80 DPP4 (0.51) TGFBR1GPR119P2RY14RORCEPHX2
SCHEMBL29849792 0.80 EPHX2 (0.57) TGFBR1GPR119P2RY14RORCEPHX2
SCHEMBL31071575 0.79 GPR119 (0.53) TGFBR1GPR119P2RY14RORCEPHX2
SCHEMBL22462913 0.78 ENPP2 (0.43) GPR119P2RY14ROCK2ENPP2SYK
SCHEMBL22462927 0.78 TGFBR1 (0.51) TGFBR1GPR119P2RY14EPHX2KDM4E
SCHEMBL18280109 0.78 TGFBR1 (0.50) TGFBR1GPR119P2RY14EPHX2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260022130-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2026-01-22 US disclosed
US-12281124-B2 Heterocyclic compounds as monoacylglycerol lipase inhibitors HOFFMANN-LA ROCHE INC. (US) 2025-04-22 US disclosed
EP-4474017-A2 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-11 EP disclosed
EP-3837263-B1 NEW HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN LA ROCHE (CH) 2024-07-03 EP disclosed
US-20240150373-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2024-05-09 US disclosed
US-11802133-B2 Heterocyclic compounds as monoacylglycerol lipase inhibitors HOFFMANN-LA ROCHE INC. (US) 2023-10-31 US disclosed
US-20230050901-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2023-02-16 US disclosed
US-20210277020-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2021-09-09 US disclosed
CN-112867720-A Novel heterocyclic compounds as monoacylglycerol lipase inhibitors 豪夫迈·罗氏有限公司 2021-05-28 CN disclosed
CN-112469724-A Novel heterocyclic compounds as monoacylglycerol lipase inhibitors 豪夫迈·罗氏有限公司 2021-03-09 CN disclosed
US-20200308190-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2020-10-01 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 (7 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-20210277020-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS MGLL, PNLIP, LPL TGFBR1 4096/4885GPR119 144/4885P2RY14 3509/4885
US-20260022130-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, LIPA, LPL TGFBR1 2972/4885GPR119 192/4885P2RY14 2911/4885
US-12281124-B2 Heterocyclic compounds as monoacylglycerol lipase inhibitors LIPC, LPL, MGLL TGFBR1 3150/4885GPR119 53/4885P2RY14 2780/4885
US-20240150373-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, LPL, MGLL TGFBR1 3150/4885GPR119 53/4885P2RY14 2780/4885
US-20200308190-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, MGLL, LPL TGFBR1 3277/4885GPR119 63/4885P2RY14 2597/4885
US-11802133-B2 Heterocyclic compounds as monoacylglycerol lipase inhibitors LIPC, LPL, MGLL TGFBR1 3150/4885GPR119 53/4885P2RY14 2780/4885
US-20230050901-A1 HETEROCYCLIC COMPOUNDS AS MONOACYLGLYCEROL LIPASE INHIBITORS LIPC, LPL, MGLL TGFBR1 3150/4885GPR119 53/4885P2RY14 2780/4885

“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.