SCHEMBL9893015

SCHEMBL9893015

CC1CCC(=O)N1c1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 6/20 0.47
POLB P06746 2/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
GAA P10253 3/20 0.44
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HPGD P15428 1/20 0.44
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ATM Q13315 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL9891732 0.88 SMN1; SMN2 (0.48) TDP1LMNAHTTALDH1A1SMN1; SMN2
SCHEMBL2568370 0.81 NPC1 (0.51) TDP1LMNAHTTALDH1A1SMN1; SMN2
SCHEMBL2568372 0.81 NPC1 (0.51) TDP1LMNAHTTALDH1A1SMN1; SMN2
SCHEMBL13285316 0.81 SMN1; SMN2 (0.50) TDP1LMNAHTTALDH1A1SMN1; SMN2
SCHEMBL2568950 0.79 SMN1; SMN2 (0.50) TDP1LMNAHTTALDH1A1SMN1; SMN2
SCHEMBL2568946 0.79 SMN1; SMN2 (0.50) TDP1LMNAHTTALDH1A1SMN1; SMN2
SCHEMBL9892997 0.75 MAPT (0.51) TDP1LMNAALDH1A1SMN1; SMN2GAA
SCHEMBL16480465 0.74 SMN1; SMN2 (0.50) TDP1LMNAHTTALDH1A1SMN1; SMN2
SCHEMBL16480423 0.74 CNR1 (0.53) TDP1LMNAHTTALDH1A1SMN1; SMN2
SCHEMBL22187889 0.73 SMN1; SMN2 (0.49) TDP1LMNAHTTALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2384320-B1 PYRROLIDINE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INT (DE) 2015-03-04 EP disclosed
US-8629157-B2 Pyrrolidine compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-01-14 US disclosed
US-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-07 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 (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-20120142677-A1 Pyrrolidine Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 TDP1 4464/4885LMNA 4696/4885HTT 3335/4885

“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.