SCHEMBL1134846

SCHEMBL1134846

CNc1ccccc1-c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.48
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
PTGS2 P35354 2/20 0.47
CYP1A2 P05177 1/20 0.44
TDP1 Q9NUW8 4/20 0.44
L3MBTL1 Q9Y468 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
PLA2G1B P04054 1/20 0.43
THRB P10828 1/20 0.43
NPY1R P25929 1/20 0.43
NPY2R P49146 1/20 0.43
ATG4B Q9Y4P1 1/20 0.43
PTGS1 P23219 1/20 0.43
MAPT P10636 2/20 0.40
RAB9A P51151 2/20 0.40
EGFR P00533 1/20 0.40
PABPC1 P11940 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 SCHEMBL1134853 0.98 F10 (0.47) F10SLC6A4SLC6A3PTGS2CYP1A2
SCHEMBL1039296 0.82 ALDH1A1 (0.50) TDP1L3MBTL1SMN1; SMN2LMNANPSR1
SCHEMBL1038045 0.81 LMNA (0.50) CYP1A2TDP1L3MBTL1SMN1; SMN2LMNA
SCHEMBL27976354 0.81 CYP1A2 (0.46) F10SLC6A4SLC6A3PTGS2CYP1A2
SCHEMBL23496291 0.80 ALDH1A1 (0.48) TDP1L3MBTL1SMN1; SMN2LMNANPSR1
SCHEMBL29413720 0.80 ALDH1A1 (0.48) TDP1L3MBTL1SMN1; SMN2LMNANPSR1
SCHEMBL1680278 0.80 ALDH1A1 (0.43) PTGS2TDP1L3MBTL1SMN1; SMN2LMNA
SCHEMBL6161641 0.79 STAT3 (0.48) SLC6A4SLC6A3PTGS2TDP1L3MBTL1
SCHEMBL18238945 0.79 ABL1 (0.50) F10TDP1L3MBTL1SMN1; SMN2LMNA
SCHEMBL3785560 0.79 TDP1 (0.44) TDP1L3MBTL1SMN1; SMN2NPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101356162-A Optically active carbamates, process for preparation thereof and use thereof as pharmaceutical intermediates EGIS GYOGYSZERGYAR NYILVANOSAN (HU) 2009-01-28 CN claimed
US-20110251389-A1 Process For Making N-(Diphenylmethyl)piperazines ZHU JIE 2011-10-13 US disclosed
US-7989623-B2 Process for making n-(diphenylmethyl)piperazines SYNTHON BV (NL) 2011-08-02 US disclosed
CN-102046612-A Processes for the synthesis of levocetirizine and intermediates for use therein CIPLA LTD 2011-05-04 CN disclosed
EP-2307392-A2 PROCESSES FOR THE SYNTHESIS OF LEVOCETIRIZINE AND INTERMEDIATES FOR USE THEREIN Cipla Limited (IN) 2011-04-13 EP disclosed
EP-2062881-B1 Process for making N-(diphenylmethyl)piperazines SYNTHON BV (NL) 2011-02-23 EP disclosed
WO-2009147389-A2 PROCESSES FOR THE SYNTHESIS OF LEVOCETIRIZINE AND INTERMEDIATES FOR USE THEREIN CIPLA LIMITED (IN) 2009-12-10 WO disclosed
US-20090143582-A1 Process for making n-(diphenylmethyl)piperazines SYNTHON BV (NL) 2009-06-04 US disclosed
WO-2009065622-A1 PROCESS FOR MAKING N-(DIPHENYLMETHYL)PIPERAZINES SYNTHON B.V. (NL) 2009-05-28 WO disclosed
EP-2062881-A1 Process for making N-(diphenylmethyl)piperazines Synthon B.V. (NL) 2009-05-27 EP disclosed
WO-2009057133-A2 A PROCESS FOR THE SYNTHESIS OF 2-[2-[4-[(4-CHLOROPHENYL)PHENYL METHYL]-1-PIPERAZINYL] ETHOXY ACETIC ACID GLENMARK GENERICS LIMITED (IN) 2009-05-07 WO disclosed
CN-101356162-A Optically active carbamates, process for preparation thereof and use thereof as pharmaceutical intermediates EGIS GYOGYSZERGYAR NYILVANOSAN (HU) 2009-01-28 CN 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-20110251389-A1 Process For Making N-(Diphenylmethyl)piperazines CYP51A1, CYP3A5, CYP4Z1 F10 4819/4885SLC6A4 795/4885SLC6A3 2826/4885
US-20090143582-A1 Process for making n-(diphenylmethyl)piperazines CYP51A1, CYP3A5, CYP4Z1 F10 4819/4885SLC6A4 795/4885SLC6A3 2826/4885

“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.