SCHEMBL2335346

SCHEMBL2335346

NCC1(c2ccccc2Cl)CC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
TAAR1 Q96RJ0 1/20 0.52
SLC6A4 P31645 12/20 0.51
SLC6A3 Q01959 12/20 0.51
SLC6A2 P23975 4/20 0.47
DPP4 P27487 1/20 0.44
HTR2A P28223 1/20 0.42
PNMT P11086 1/20 0.40

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
Hydrochloric Acid SCHEMBL2338221 0.98 SLC6A4 (0.50) MAOAMAOBTAAR1SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL29428978 0.86 SLC6A4 (0.44) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL8185838 0.81 DPP4 (0.64) SLC6A4SLC6A3SLC6A2DPP4
SCHEMBL14482778 0.81 DPP4 (0.64) SLC6A4SLC6A3SLC6A2DPP4
SCHEMBL805454 0.79 GRIN1 (0.50) TAAR1SLC6A4SLC6A3HTR2A
SCHEMBL17761216 0.76 HDAC4 (0.45) SLC6A4
SCHEMBL24018816 0.75 SLC6A3 (0.54) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL14920764 0.75 TAAR1 (0.52) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL11480787 0.75 TAAR1 (0.52) MAOAMAOBTAAR1SLC6A4SLC6A3
SCHEMBL17187886 0.72 SLC6A3 (0.83) MAOAMAOBTAAR1SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2358716-B1 INHIBITORS OF FATTY ACID BINDING PROTEIN (FABP) MERCK SHARP & DOHME (US) 2016-01-06 EP disclosed
EP-2485735-B1 INHIBITORS OF FATTY ACID BINDING PROTEIN (FABP) MERCK SHARP & DOHME (US) 2015-07-29 EP disclosed
US-8815875-B2 Inhibitors of fatty acid binding protein (FABP) MERCK SHARP & DOHME CORP. (US) 2014-08-26 US disclosed
US-20110237575-A1 INHIBITORS OF FATTY ACID BINDING PROTEIN (FABP) MERCK SHARP & DOHME LLC 2011-09-29 US disclosed
EP-2358716-A1 INHIBITORS OF FATTY ACID BINDING PROTEIN (FABP) Schering Corporation (US) 2011-08-24 EP disclosed
WO-2010056631-A1 INHIBITORS OF FATTY ACID BINDING PROTEIN (FABP) SCHERING CORPORATION (US) 2010-05-20 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-20110237575-A1 INHIBITORS OF FATTY ACID BINDING PROTEIN (FABP) FABP4, FABP1, FABP3 MAOA 3482/4885MAOB 2364/4885TAAR1 3865/4885

“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.