SCHEMBL475658

SCHEMBL475658

COC(=O)C1CCC(C)=N1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
HIF1A Q16665 1/20 0.33
PPM1B O75688 1/20 0.32
PTPN1 P18031 1/20 0.32
PPP1CC P36873 1/20 0.32
BRD4 O60885 1/20 0.31
TP53 P04637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL475660 1.00 CYP1A2 (0.33) CYP1A2HIF1APPM1BPTPN1PPP1CC
SCHEMBL14649971 1.00 CYP1A2 (0.33) CYP1A2HIF1APPM1BPTPN1PPP1CC
SCHEMBL14915676 0.81 PDK1 (0.38) PPM1BPTPN1PPP1CCKDM4EGAA
SCHEMBL8752895 0.81 PDK1 (0.38) PPM1BPTPN1PPP1CCKDM4EGAA
SCHEMBL24664101 0.80 CYP1A2 (0.33) CYP1A2HIF1APPM1BPTPN1PPP1CC
SCHEMBL19386329 0.80 CYP1A2 (0.33) CYP1A2HIF1APPM1BPTPN1PPP1CC
SCHEMBL433180 0.78 POLB (0.33) CYP1A2HIF1APPM1BPTPN1PPP1CC
SCHEMBL24664106 0.78 POLB (0.33) CYP1A2HIF1APPM1BPTPN1PPP1CC
SCHEMBL907524 0.78 POLB (0.33) CYP1A2HIF1APPM1BPTPN1PPP1CC
SCHEMBL31264948 0.78 CYP2C19 (0.42) CYP1A2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919851-B2 2-pyrrolidine phenylhydrazides antibacterial agents ABAC Therapeutics, S.L. (ES) 2021-02-16 US disclosed
EP-3490984-B1 2-PYRROLIDINE PHENYLHYDRAZIDES ANTIBACTERIAL AGENTS Abac Therapeutics Sl (ES) 2020-09-09 EP disclosed
EP-3256463-B1 1-(HET)ARYLSULFONYL-(PYRROLIDINE OR PIPERIDINE)-2-CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2019-10-09 EP disclosed
US-20190177272-A1 2-PYRROLIDINE PHENYLHYDRAZIDES ANTIBACTERIAL AGENTS ABAC Therapeutics, S.L. (ES) 2019-06-13 US disclosed
EP-3490984-A1 2-PYRROLIDINE PHENYLHYDRAZIDES ANTIBACTERIAL AGENTS Abac Therapeutics, S.L (ES) 2019-06-05 EP disclosed
WO-2018020004-A1 2-PYRROLIDINE PHENYLHYDRAZIDES ANTIBACTERIAL AGENTS ABAC THERAPEUTICS, S.L (ES) 2018-02-01 WO disclosed
US-20130102593-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF PURDUE RESEARCH FOUNDATION 2013-04-25 US disclosed
US-20130059840-A1 SULFONAMIDO PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2013-03-07 US disclosed
US-20120295894-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF BILCER GEOFFREY M (US) 2012-11-22 US disclosed
US-20120214802-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF PURDUE RESEARCH FOUNDATION 2012-08-23 US disclosed
EP-2486006-A1 SULFONAMIDO PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2012-08-15 EP disclosed
EP-2411000-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2012-02-01 EP disclosed
EP-2349244-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2011-08-03 EP disclosed
WO-2011044057-A1 SULFONAMIDO PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2011-04-14 WO disclosed
WO-2010110817-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2010-09-30 WO disclosed
WO-2010042892-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2010-04-15 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 (6 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-20190177272-A1 2-PYRROLIDINE PHENYLHYDRAZIDES ANTIBACTERIAL AGENTS ATAD2, ATAD2B, ATAD5 CYP1A2 547/4885HIF1A 980/4885PPM1B 94/4885
US-20130059840-A1 SULFONAMIDO PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF BACE1, BACE2, GSAP CYP1A2 4674/4885HIF1A 4028/4885PPM1B 485/4885
US-20120295894-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF BACE1, BACE2, APP CYP1A2 4473/4885HIF1A 3527/4885PPM1B 547/4885
US-10919851-B2 2-pyrrolidine phenylhydrazides antibacterial agents ATAD2, ATAD2B, ATAD5 CYP1A2 547/4885HIF1A 980/4885PPM1B 94/4885
US-20120214802-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF BACE1, BACE2, APP CYP1A2 4473/4885HIF1A 3527/4885PPM1B 547/4885
US-20130102593-A1 PYRROLIDINE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF BACE1, BACE2, APP CYP1A2 4473/4885HIF1A 3527/4885PPM1B 547/4885

“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.