SCHEMBL9893029

SCHEMBL9893029

CC1CCC(=O)N1c1ccc(Cl)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
GPR55 Q9Y2T6 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 2/20 0.40
GPR119 Q8TDV5 1/20 0.40
KDM4E B2RXH2 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NOTUM Q6P988 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
MAPT P10636 1/20 0.38
RECQL P46063 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
GABRA4 P48169 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL16480457 0.83 NPC1 (0.45) SMN1; SMN2ALDH1A1GPR119NPSR1TSHR
SCHEMBL9893027 0.82 GRM5 (0.42) GPR119ABL1HDAC6
SCHEMBL13285315 0.82 GRIN2D (0.38) MAPTCNR2CCNA2CDK2ABL1
SCHEMBL9891778 0.81 GAA (0.42) GAAGPR55SMN1; SMN2ALDH1A1GPR119
SCHEMBL16480490 0.81 HRH3 (0.40) ALDH1A1KDM4ENPSR1MAPTCYP1A2
SCHEMBL9892979 0.80 GPR119 (0.35) GPR119NOTUMSRD5A1ABL1
SCHEMBL9105776 0.78 P2RX7 (0.43) GAAGPR55SMN1; SMN2ALDH1A1KDM4E
SCHEMBL9110156 0.78 P2RX7 (0.43) GAAGPR55SMN1; SMN2ALDH1A1KDM4E
SCHEMBL9893014 0.78 CNR1 (0.50) ALDH1A1GPR119KDM4ECNR2
SCHEMBL9892997 0.78 MAPT (0.51) GAASMN1; SMN2ALDH1A1GPR119KDM4E

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 GAA 4474/4885GPR55 11/4885SMN1; SMN2 4659/4885

“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.