SCHEMBL7303096

SCHEMBL7303096

CC(C)(C)OC(=O)N1CCC(CO)(C(=O)O)CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
NR1H2 P55055 1/20 0.42
MMP13 P45452 2/20 0.41
ADAM17 P78536 2/20 0.41
MMP2 P08253 1/20 0.41
HPGD P15428 1/20 0.41
EPHX2 P34913 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
ATM Q13315 1/20 0.40
TACR1 P25103 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
GPR119 Q8TDV5 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
SCHEMBL12194260 0.91 CYP4F2 (0.47) USP2SMN1; SMN2CYP4F2CYP4A11NR1H2
SCHEMBL965651 0.87 USP2 (0.51) USP2SMN1; SMN2CYP4F2CYP4A11HPGD
SCHEMBL607839 0.86 USP2 (0.46) USP2SMN1; SMN2CYP4F2CYP4A11HPGD
SCHEMBL20423343 0.86 USP2 (0.46) USP2SMN1; SMN2CYP4F2CYP4A11MMP13
SCHEMBL14155541 0.86 USP2 (0.46) USP2SMN1; SMN2CYP4F2CYP4A11HPGD
SCHEMBL17707510 0.84 USP2 (0.45) USP2SMN1; SMN2CYP4F2CYP4A11HPGD
SCHEMBL4295685 0.84 PKM (0.49) USP2SMN1; SMN2CYP4F2CYP4A11NR1H2
SCHEMBL25699938 0.83 NR1H2 (0.44) USP2SMN1; SMN2CYP4F2CYP4A11NR1H2
SCHEMBL29993582 0.83 USP2 (0.44) USP2SMN1; SMN2CYP4F2CYP4A11HPGD
SCHEMBL89509 0.83 USP2 (0.44) USP2SMN1; SMN2CYP4F2CYP4A11HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024054919-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (CN) 2024-03-14 WO disclosed
CN-106061971-B Pyrrolidinyl sulfone derivatives and their use as ROR gamma modulators 百时美施贵宝公司 2019-03-12 CN disclosed
EP-3092229-B1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS BRISTOL MYERS SQUIBB CO (US) 2018-03-28 EP disclosed
EP-3092229-A1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS Bristol-Myers Squibb Company (US) 2016-11-16 EP disclosed
US-20160326108-A1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS BRISTOL MYERS SQUIBB CO (US) 2016-11-10 US disclosed
CN-106061971-A Pyrrolidinyl sulfone derivatives and their use as ROR gamma modulators 百时美施贵宝公司 2016-10-26 CN disclosed
US-9458171-B2 Pyrrolidinyl sulfone RORγ modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2016-10-04 US disclosed
WO-2015103509-A1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-07-09 WO disclosed
US-20150191483-A1 PYRROLIDINYL SULFONE RORGAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2015-07-09 US disclosed
WO-2012172043-A1 PURINE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS FOR PREVENTION OR TREATMENT OF BACTERIAL INFECTIONS LABORATOIRE BIODIM (FR) 2012-12-20 WO disclosed
EP-0780386-B1 Matrix metalloprotease inhibitors HOFFMANN LA ROCHE (CH) 2002-10-02 EP disclosed
US-5932595-A ANTIARTHRITIC AGENT; MULTIPLE SCLEROSIS; OSTEOPOROSIS; RESPIRATORY SYSTEM DISORDERS; SKIN DISORDERS; ANTIULCER AGENT SYNTEX (U.S.A.) INC. (US) 1999-08-03 US disclosed
EP-0780386-A1 Matrix metalloprotease inhibitors F. HOFFMANN-LA ROCHE AG (CH) 1997-06-25 EP 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 (2 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-20160326108-A1 PYRROLIDINYL SULFONE DERIVATIVES AND THEIR USE AS ROR GAMMA MODULATORS RORC, RORB, RORA USP2 3493/4885SMN1; SMN2 1758/4885CYP4F2 570/4885
US-20150191483-A1 PYRROLIDINYL SULFONE RORGAMMA MODULATORS RORC, RORB, RORA USP2 3646/4885SMN1; SMN2 1871/4885CYP4F2 499/4885

“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.