SCHEMBL2863138

SCHEMBL2863138

N#CCNc1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
IDO1 P14902 1/20 0.44
EPHB3 P54753 1/20 0.41
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
MAPK1 P28482 2/20 0.40
ALDH1A1 P00352 1/20 0.40
ADRA2B P18089 1/20 0.40
ADRA2C P18825 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 2/20 0.40
TSHR P16473 2/20 0.40
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HTT P42858 2/20 0.37
HPGD P15428 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
CACNA1B Q00975 1/20 0.37
APBA1 Q02410 1/20 0.37

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
SCHEMBL728548 0.84 MAPT (0.41) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL25001918 0.81 MAOA (0.47) MAPTIDO1EPHB3KMT2AMEN1
SCHEMBL31177965 0.81 MAOA (0.47) MAPTIDO1EPHB3KMT2AMEN1
SCHEMBL6966695 0.80 MAPT (0.42) MAPTIDO1EPHB3KMT2AMEN1
SCHEMBL28648630 0.78 ALDH1A1 (0.39) MAPTIDO1KMT2AMEN1MAPK1
SCHEMBL11187663 0.77 CYP1A2 (0.39) MAPTKMT2ASMN1; SMN2LMNA
SCHEMBL1826516 0.77 MAPT (0.61) MAPTKMT2AMEN1ALDH1A1ADRA2B
SCHEMBL9412138 0.76 LMNA (0.44) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL1116563 0.76 IDO1 (0.48) MAPTIDO1KMT2AMEN1ALDH1A1
SCHEMBL9396474 0.75 MAPT (0.42) MAPTKMT2AMEN1MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2168969-A2 Racemization and Enantiomer Separation of Clopidogrel TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2010-03-31 EP disclosed
EP-1483269-B1 RACEMIZATION AND ENANTIOMER SEPARATION OF CLOPIDOGREL TEVA PHARMA (IL) 2009-10-14 EP disclosed
US-7259261-B2 Racemization and enantiomer separation of clopidogrel TEVA Gyógyszergyár Zártkörűen Működő Részvénytársaság (HU) 2007-08-21 US disclosed
US-20050049275-A1 Racemization and enantiomer separation of clopidogrel ENTIRE INTEREST 2005-03-03 US disclosed
EP-1483269-A1 RACEMIZATION AND ENANTIOMER SEPARATION OF CLOPIDOGREL Teva Pharmaceutical Industries Limited (IL) 2004-12-08 EP disclosed
US-6800759-B2 REACTING MIXTURE OF (R) AND (S) CLOPIDOGREL FREE BASE WITH LEVOROTATORY CAMPHORSULFONIC ACID IN C5 TO C12 HYDROCARBON TO PRECIPITATE (S) CLOPIDOGREL CAMPHORSULFONATE, CONVERTING TO FREE BASE, PRECIPITATING CLOPIDOGREL BISULFATE IN SOLVENT TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2004-10-05 US disclosed
US-6737411-B2 CRYSTALLIZING AS CAMPHOR SULFONATE SALT; CONVERTING PURIFIED MATERIAL BACK TO FREE BASE FORM TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2004-05-18 US disclosed
WO-2004013147-A1 RACEMIZATION AND ENANTIOMER SEPARATION OF CLOPIDOGREL TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2004-02-12 WO disclosed
US-20040024012-A1 Racemization and enantiomer separation of clopidogrel TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2004-02-05 US disclosed
US-20040024011-A1 RACEMIZATION AND ENANTIOMER SEPARATION OF CLOPIDOGREL TEVA PHARMACEUTICALS USA, INC. 2004-02-05 US disclosed
US-4420619-A Imidazole urea and amido compounds CIBA-GEIGY CORPORATION (US) 1983-12-13 US disclosed
US-4343810-A Method of inhibiting sickling of sickle erythrocytes using 2-((haloanilino)methyl)-2-imidazolines THE DOW CHEMICAL COMPANY (US) 1982-08-10 US disclosed
EP-0004561-B1 UREA AND AMIDE DERIVATIVES, THEIR PREPARATION, PHARMACEUTICALS CONTAINING THEM AND THEIR USE FOR PREPARING PHARMACEUTICAL COMPOSITIONS CIBA-GEIGY AG (CH) 1981-11-04 EP disclosed
US-4292429-A Imidazole urea and amido compounds CIBA-GEIGY CORPORATION (US) 1981-09-29 US 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 (3 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-20040024012-A1 Racemization and enantiomer separation of clopidogrel SRR, TBXA2R, PTGIR MAPT 4200/4885IDO1 2530/4885EPHB3 1028/4885
US-20040024011-A1 RACEMIZATION AND ENANTIOMER SEPARATION OF CLOPIDOGREL SRR, TBXA2R, PTGIR MAPT 4200/4885IDO1 2530/4885EPHB3 1028/4885
US-20050049275-A1 Racemization and enantiomer separation of clopidogrel SRR, TBXA2R, PTGIR MAPT 4200/4885IDO1 2530/4885EPHB3 1028/4885

“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.