SCHEMBL3393682

SCHEMBL3393682

CCCNc1ccc(Cl)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.53
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 1/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CYP3A4 P08684 1/20 0.50
LMNA P02545 2/20 0.46
POLB P06746 1/20 0.46
GRIN1 Q05586 3/20 0.44
KCNH2 Q12809 3/20 0.44
GRIN2B Q13224 3/20 0.44
EPHX1 P07099 1/20 0.44
EPHX2 P34913 1/20 0.44
RAPGEF4 Q8WZA2 1/20 0.43
MMP8 P22894 1/20 0.42
MMP14 P50281 1/20 0.42
CA14 Q9ULX7 1/20 0.42
APEX1 P27695 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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 SCHEMBL3398835 0.98 ABL1 (0.51) ABL1MEN1KMT2AMAPTATM
SCHEMBL6950384 0.88 ABL1 (0.63) ABL1MEN1KMT2AMAPTATM
SCHEMBL11327501 0.86 ABL1 (0.71) ABL1MEN1KMT2AMAPTATM
SCHEMBL11331995 0.85 ABL1 (0.73) ABL1MEN1KMT2AMAPTATM
SCHEMBL11332024 0.85 ABL1 (0.73) ABL1MEN1KMT2AMAPTATM
SCHEMBL11338034 0.85 ABL1 (0.73) ABL1MEN1KMT2AMAPTATM
SCHEMBL7647728 0.85 ABL1 (0.73) ABL1MEN1KMT2AMAPTATM
SCHEMBL11324801 0.85 ABL1 (0.73) ABL1MEN1KMT2AMAPTATM
SCHEMBL11332987 0.85 ABL1 (0.73) ABL1MEN1KMT2AMAPTATM
SCHEMBL11332010 0.85 ABL1 (0.73) ABL1MEN1KMT2AMAPTATM

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 20 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
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 claimed
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 claimed
JP-2002500641-A 2002-01-08 JP claimed
CN-1259119-A Substituted 3, 3-diamino-2-propenenitriles, their preparation and use NOVO NORDISK AS (DK) 2000-07-05 CN claimed
EP-0998451-A1 SUBSTITUTED 3,3-DIAMINO-2-PROPENENITRILES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-05-10 EP claimed
WO-1998050344-A1 SUBSTITUTED 3,3-DIAMINO-2-PROPENENITRILES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1998-11-12 WO claimed
WO-2023107547-A2 AZETIDINE AND SPIROAZETIDINE COMPOUNDS AND USES THEREOF Kineta, Inc. (US) 2023-06-15 WO disclosed
CN-106458939-B * oxazolidinyl compound and the selective androgen receptor agonist comprising the compound 东亚ST株式会社 2019-05-17 CN disclosed
WO-2017021795-A1 A HERBICIDAL COMPOSITION AND PROCESS THEREOF UPL LIMITED (IN) 2017-02-09 WO 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
CN-1259119-A Substituted 3, 3-diamino-2-propenenitriles, their preparation and use NOVO NORDISK AS (DK) 2000-07-05 CN disclosed
EP-0998451-A1 SUBSTITUTED 3,3-DIAMINO-2-PROPENENITRILES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-05-10 EP disclosed
WO-1998050344-A1 SUBSTITUTED 3,3-DIAMINO-2-PROPENENITRILES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1998-11-12 WO disclosed
US-4797146-A INSECTICIDES, FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1989-01-10 US disclosed
US-4765824-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1988-08-23 US disclosed
EP-0002721-B1 PROCESS FOR PREPARING HYDRAZINES BAYER AG (DE) 1981-09-02 EP disclosed
EP-0002721-A2 Process for preparing hydrazines BAYER AG (DE) 1979-07-11 EP 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-20110053985-A1 NOVEL PIPERIDINE-4-CARBOXYLIC ACID PHENYL-ALKYL-AMIDE DERIVATIVES AND THEIR USE AS MONOAMINE NEUROTRANSMITTER RE-UPTAKE INHIBITORS SLC18A2, SLC6A2, SLC18A3 ABL1 976/4885MEN1 3509/4885KMT2A 1248/4885

“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.