SCHEMBL3400390

SCHEMBL3400390

C1CCN([C@@H]2CCNC2)C1.NC(=O)Cl

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.56
L3MBTL3 Q96JM7 7/20 0.40
L3MBTL1 Q9Y468 6/20 0.40
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
CYP2D6 P10635 1/20 0.39
ARG1 P05089 1/20 0.36
ARG2 P78540 1/20 0.36
PARP1 P09874 1/20 0.35
MBTD1 Q05BQ5 4/20 0.34
TP53BP1 Q12888 1/20 0.34
L3MBTL4 Q8NA19 1/20 0.34
DPP4 P27487 2/20 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
SCHEMBL3402669 1.00 HTR6 (0.56) HTR6L3MBTL3L3MBTL1KDM4EMAPT
SCHEMBL3430556 0.89 L3MBTL3 (0.49) HTR6L3MBTL3L3MBTL1MBTD1TP53BP1
[1,4']Bipiperidinyl SCHEMBL4727341 0.87 L3MBTL3 (0.48) HTR6L3MBTL3L3MBTL1KDM4EKMT2A
SCHEMBL238942 0.84 HTR6 (0.75) HTR6L3MBTL3L3MBTL1ARG1ARG2
SCHEMBL223255 0.84 HTR6 (0.75) HTR6L3MBTL3L3MBTL1ARG1ARG2
SCHEMBL1447785 0.84 HTR6 (0.75) HTR6L3MBTL3L3MBTL1ARG1ARG2
Hydrochloric Acid SCHEMBL1814485 0.82 HTR6 (0.72) HTR6L3MBTL3L3MBTL1KMT2AMBTD1
Hydrochloric Acid SCHEMBL3335525 0.82 HTR6 (0.72) HTR6L3MBTL3L3MBTL1KMT2AMBTD1
Hydrochloric Acid SCHEMBL1809050 0.82 HTR6 (0.72) HTR6L3MBTL3L3MBTL1KMT2AMBTD1
SCHEMBL10265670 0.82 HTR6 (0.72) HTR6L3MBTL3L3MBTL1CYP2D6MBTD1

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-2250167-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS Chlorion Pharma, Inc. (CA) 2010-11-17 EP disclosed
US-20090275538-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS UNIVERSITE LAVAL (CA) 2009-11-05 US disclosed
WO-2009097695-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS CHLORION PHARMA, INC. (CA) 2009-08-13 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 (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-20090275538-A1 ARYLMETHYLIDENE HETEROCYCLES AS NOVEL ANALGESICS OPRL1, OPRK1, AHR HTR6 246/4885L3MBTL3 2314/4885L3MBTL1 3557/4885

“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.