SCHEMBL3748178

SCHEMBL3748178

CC(=O)NC1CNC(=O)C1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.43
ATM Q13315 1/20 0.41
HPGDS O60760 2/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MTNR1A P48039 4/20 0.39
MTNR1B P49286 3/20 0.39
TLR4 O00206 1/20 0.36
CA1 P00915 3/20 0.35
CA2 P00918 3/20 0.35
CA12 O43570 2/20 0.35
CA7 P43166 2/20 0.35
CA14 Q9ULX7 2/20 0.35
EPHX2 P34913 1/20 0.35
CA9 Q16790 1/20 0.34
FPR1 P21462 1/20 0.33
FPR2 P25090 1/20 0.33
HPSE Q9Y251 1/20 0.33
OGA O60502 1/20 0.33

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
SCHEMBL23570889 1.00 IDO1 (0.43) IDO1ATMHPGDSKDM4EALDH1A1
SCHEMBL16467987 0.82 IDO1 (0.43) IDO1HPGDSEPHX2FPR1FPR2
SCHEMBL4328102 0.82 IDO1 (0.43) IDO1HPGDSEPHX2FPR1FPR2
SCHEMBL23275332 0.82 IDO1 (0.43) IDO1HPGDSEPHX2FPR1FPR2
SCHEMBL12678516 0.81 TLR4 (0.44) ATMKDM4EALDH1A1MTNR1AMTNR1B
SCHEMBL27258760 0.81 MTNR1A (0.44) ATMKDM4EALDH1A1MTNR1AMTNR1B
SCHEMBL17282682 0.80 HPGDS (0.37) IDO1HPGDS
SCHEMBL17282603 0.80 HPGDS (0.37) IDO1HPGDS
SCHEMBL23571006 0.80 IDO1 (0.43) IDO1HPGDSEPHX2FPR1FPR2
SCHEMBL2481459 0.80 IDO1 (0.43) IDO1HPGDSEPHX2FPR1FPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023036140-A1 3CLPRO PROTEASE INHIBITOR 上海齐鲁制药研究中心有限公司 2023-03-16 WO disclosed
US-8242285-B2 N-tert-butoxycarbonyl-2-pyrrolidinones and production method thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-14 US disclosed
US-20100280259-A1 N-Tert-Butoxycarbonyl-2-Pyrrolidinones and Production Method Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-04 US disclosed
US-20090163722-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PRODUCTION METHOD THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-25 US disclosed
CN-101415676-A N-tert-butoxycarbonyl-2-pyrrolidinone compounds and method for producing the same SUMITOMO CHEMICAL CO (JP) 2009-04-22 CN disclosed
EP-2008999-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PROCESS FOR PRODUCING THE SAME Sumitomo Chemical Company, Limited (JP) 2008-12-31 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-20090163722-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PRODUCTION METHOD THEREOF TERT, CBR1, TELO2 IDO1 2456/4885ATM 2518/4885HPGDS 1754/4885
US-20100280259-A1 N-Tert-Butoxycarbonyl-2-Pyrrolidinones and Production Method Thereof TERT, CBR1, TELO2 IDO1 2456/4885ATM 2518/4885HPGDS 1754/4885

“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.