SCHEMBL6204726

SCHEMBL6204726

C[C@@H](c1ccccc1)N1CC(F)C(C2(NC(=O)OC(C)(C)C)CC2)C1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 3/20 0.36
CTSK P43235 3/20 0.35
RIPK1 Q13546 1/20 0.35
KMT2A Q03164 1/20 0.35
USP30 Q70CQ3 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
OPRL1 P41146 1/20 0.34
CTSS P25774 1/20 0.34
ATM Q13315 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34

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
SCHEMBL6204723 1.00 UTS2R (0.36) UTS2RCTSKRIPK1KMT2AUSP30
SCHEMBL6204721 1.00 UTS2R (0.36) UTS2RCTSKRIPK1KMT2AUSP30
SCHEMBL5781257 0.96 UTS2R (0.35) UTS2RCTSKRIPK1KMT2AUSP30
SCHEMBL5781254 0.96 UTS2R (0.35) UTS2RCTSKRIPK1KMT2AUSP30
SCHEMBL6204257 0.96 UTS2R (0.35) UTS2RCTSKRIPK1KMT2AUSP30
SCHEMBL6204252 0.96 UTS2R (0.35) UTS2RCTSKRIPK1KMT2AUSP30
SCHEMBL6204249 0.96 UTS2R (0.35) UTS2RCTSKRIPK1KMT2AUSP30
SCHEMBL6204711 0.82 KMT2A (0.41) UTS2RCTSKKMT2ACTSSATM
SCHEMBL6204716 0.82 KMT2A (0.41) UTS2RCTSKKMT2ACTSSATM
SCHEMBL6204713 0.82 KMT2A (0.41) UTS2RCTSKKMT2ACTSSATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1020459-B1 CIS-DISUBSTITUTED AMINOCYCLOALKYL-PYRROLIDINE DERIVATIVES DAIICHI SEIYAKU CO (JP) 2005-04-06 EP disclosed
US-20020077345-A1 Cis-substituted aminocycloalkylpyrrolidine derivatives DAIICHI PHARMACEUTICAL CO., LTD. 2002-06-20 US disclosed
US-6184388-B1 ANTIBACTERIAL AND ANTIMICROBIAL, QUINOLINE ANTIBIOTIC DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-02-06 US disclosed
US-6121285-A 5-AMINO-7-(4-(1-AMINOCYCLOPROPYL-3-FLUORO-1-PYRROLIDINYL)-6 -FLUORO-1-(2-FLUORO-1-CYCLOPROPYL)-1,4-DIHYDRO-8-METHOXY-4-OXOQUINOLINE-3 -CARBOXYLIC ACID, FOR EXAMPLE; ANTIMICROBIAL DRUGS WITH HIGH SAFETY DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-09-19 US disclosed
EP-1020459-A1 CIS-DISUBSTITUTED AMINOCYCLOALKYL-PYRROLIDINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-07-19 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 (1 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-20020077345-A1 Cis-substituted aminocycloalkylpyrrolidine derivatives Q6ZSR9, ARG1, ASNS UTS2R 1096/4885CTSK 498/4885RIPK1 2375/4885

“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.