SCHEMBL3398739

SCHEMBL3398739

NC(=O)Cc1ccc(Cl)c(Br)c1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.47
SLC6A4 P31645 2/20 0.44
HTR2A P28223 1/20 0.44
POLB P06746 2/20 0.43
HSP90AA1 P07900 1/20 0.43
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
PIK3CA P42336 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
MET P08581 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
SCHEMBL3397803 0.85 CA2 (0.47) CA2SLC6A4HTR2APOLBHSP90AA1
SCHEMBL15055216 0.83 CA2 (0.59) CA2POLBKDM4EALDH1A1LMNA
SCHEMBL1029174 0.82 SLC6A4 (0.54) CA2SLC6A4HTR2APOLBHSP90AA1
SCHEMBL3392851 0.82 CA2 (0.52) CA2POLBKDM4EALDH1A1LMNA
SCHEMBL15471928 0.81 CA2 (0.41) CA2POLBHSP90AA1ALDH1A1PIK3CA
Hydrochloric Acid SCHEMBL5385069 0.81 CA2 (0.50) CA2POLBKDM4EALDH1A1LMNA
SCHEMBL6684335 0.79 CA2 (0.53) CA2
SCHEMBL31480988 0.78 CA2 (0.47) CA2SLC6A4HTR2APOLBKDM4E
SCHEMBL3395940 0.78 CA2 (0.47) CA2SLC6A4HTR2APOLBKDM4E
SCHEMBL19641588 0.78 CA2 (0.47) CA2POLBKDM4EALDH1A1LMNA

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-20110053985-A1 NOVEL PIPERIDINE-4-CARBOXYLIC ACID PHENYL-ALKYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2011-03-03 US claimed
US-20250346567-A1 SUBSTITUTED PYRIDINE AND PHENYL COMPOUNDS PFIZER INC. (US) 2025-11-13 US disclosed
US-20110053985-A1 NOVEL PIPERIDINE-4-CARBOXYLIC ACID PHENYL-ALKYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2011-03-03 US disclosed
EP-2245011-A1 NOVEL PIPERIDINE-4-CARBOXYLIC ACID PHENYL-ALKYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NeuroSearch A/S (DK) 2010-11-03 EP disclosed
WO-2009090173-A1 NOVEL PIPERIDINE-4-CARBOXYLIC ACID PHENYL-ALKYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS NEUROSEARCH A/S (DK) 2009-07-23 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 (2 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-20250346567-A1 SUBSTITUTED PYRIDINE AND PHENYL COMPOUNDS PAH, PC, MPC2 CA2 3780/4885SLC6A4 357/4885HTR2A 3438/4885
US-20110053985-A1 NOVEL PIPERIDINE-4-CARBOXYLIC ACID PHENYL-ALKYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS SLC18A2, SLC6A2, SLC18A3 CA2 2007/4885SLC6A4 4/4885HTR2A 43/4885

“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.