SCHEMBL2610245

SCHEMBL2610245

Cc1c(C(=O)Cl)sc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.59
PRNP P04156 1/20 0.59
HSD11B1 P28845 1/20 0.54
MCL1 Q07820 1/20 0.51
LIMK1 P53667 2/20 0.50
MAOB P27338 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
IKBKB O14920 1/20 0.47
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TP53 P04637 2/20 0.47
CD274 Q9NZQ7 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46

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
SCHEMBL16598796 0.85 RXFP1 (0.73) RXFP1PRNPHSD11B1MCL1LIMK1
SCHEMBL584871 0.83 RXFP1 (0.71) RXFP1PRNPHSD11B1MCL1LIMK1
SCHEMBL2610250 0.83 RXFP1 (0.61) RXFP1PRNPHSD11B1MCL1LIMK1
SCHEMBL29939764 0.83 RXFP1 (0.71) RXFP1PRNPHSD11B1MCL1LIMK1
SCHEMBL29483598 0.81 LIMK1 (0.68) RXFP1PRNPHSD11B1MCL1LIMK1
SCHEMBL2702750 0.81 LIMK1 (0.68) RXFP1PRNPHSD11B1MCL1LIMK1
SCHEMBL6621845 0.80 RXFP1 (0.62) RXFP1PRNPHSD11B1MCL1LIMK1
Potassium Ion SCHEMBL15876132 0.80 RXFP1 (0.62) RXFP1PRNPHSD11B1MCL1LIMK1
SCHEMBL64428 0.79 MCL1 (0.73) RXFP1PRNPMCL1HDAC1HDAC8
SCHEMBL27629193 0.79 MCL1 (0.53) RXFP1PRNPMCL1LIMK1MAOB

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
US-8748417-B2 Amino-pyrrolidine-azetidine diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2014-06-10 US disclosed
US-8575363-B2 Amino-pyrrolidine-azetidine diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2013-11-05 US disclosed
US-20130261130-A1 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2013-10-03 US disclosed
US-20130196970-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2013-08-01 US disclosed
US-20120101081-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA, NV (BE) 2012-04-26 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 (3 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-20130196970-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, MGLL RXFP1 877/4885PRNP 1005/4885HSD11B1 973/4885
US-20130261130-A1 NEUROTRYPSIN INHIBITORS MTPN, CHRNA7, CHRNA10 RXFP1 97/4885PRNP 549/4885HSD11B1 804/4885
US-20120101081-A1 AMINO-PYRROLIDINE-AZETIDINE DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, MGLL RXFP1 877/4885PRNP 1005/4885HSD11B1 973/4885

“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.