SCHEMBL10688994

SCHEMBL10688994

ClCC=Cc1ccc(Cl)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
MAPT P10636 6/20 0.46
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
GAA P10253 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
LMNA P02545 4/20 0.43
HTT P42858 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
POLB P06746 1/20 0.42
PKM P14618 2/20 0.42
TTR P02766 1/20 0.42
ALPL P05186 1/20 0.41
GLA P06280 1/20 0.41
ALPG P10696 1/20 0.41
HPGD P15428 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
SCHEMBL10688991 1.00 TDP1 (0.52) TDP1MAPTALDH1A1KDM4EGAA
SCHEMBL11331176 0.82 TDP1 (0.50) TDP1MAPTALDH1A1KDM4EGAA
SCHEMBL3605648 0.82 TDP1 (0.50) TDP1MAPTALDH1A1KDM4EGAA
SCHEMBL29528455 0.82 TDP1 (0.50) TDP1MAPTALDH1A1KDM4EGAA
SCHEMBL2093129 0.82 TDP1 (0.55) TDP1MAPTALDH1A1KDM4EGAA
SCHEMBL256703 0.82 TDP1 (0.50) TDP1MAPTALDH1A1KDM4EGAA
SCHEMBL10323624 0.82 TDP1 (0.50) TDP1MAPTALDH1A1KDM4EGAA
SCHEMBL3605644 0.82 TDP1 (0.50) TDP1MAPTALDH1A1KDM4EGAA
SCHEMBL2093131 0.82 TDP1 (0.55) TDP1MAPTALDH1A1KDM4EGAA
SCHEMBL1569641 0.82 TDP1 (0.50) TDP1MAPTALDH1A1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103130663-B Cinnamylate ester compound and application thereof UNIV QINGDAO SCIENCE & TECHNOLOGY 2014-06-18 CN disclosed
CN-103130663-A Cinnamylate ester compound and application thereof UNIV QINGDAO SCIENCE & TECHNOLOGY 2013-06-05 CN disclosed
US-4742062-A Benzylpiperazine compound and pharmaceutical composition as hypolipidemic agent KANEBO, LTD. (JP) 1988-05-03 US disclosed
EP-0209843-A2 Benzylpiperazine compound, preparation thereof, pharmaceutical composition, and use KANEBO, LTD. (JP) 1987-01-28 EP disclosed
US-4431815-A CARDIOTONIC AND ANTISHOCK AGENTS; ANTICOAGULANTS BURROUGHS WELLCOME CO. (US) 1984-02-14 US disclosed
US-4425354-A CARDIOVASCULAR DISORDERS BURROUGHS WELLCOME CO. (US) 1984-01-10 US disclosed
EP-0003732-B1 IMIDAZOLE DERIVATIVES AND SALTS THEREOF, THEIR SYNTHESIS, AND PHARMACEUTICAL FORMULATIONS THEREOF THE WELLCOME FOUNDATION LIMITED (GB) 1983-10-19 EP disclosed
US-4405634-A Imidazole derivatives for treating myocardial infarction BURROUGHS WELLCOME CO. (US) 1983-09-20 US disclosed
US-4396771-A THROMBOEMBOLIC DISORDERS, SHOCK BURROUGHS WELLCOME CO. (US) 1983-08-02 US disclosed
US-4357340-A Imidazole derivatives and angina pectoris BURROUGHS WELLCOME CO. (US) 1982-11-02 US disclosed
EP-0003732-A2 Imidazole derivatives and salts thereof, their synthesis, and pharmaceutical formulations thereof THE WELLCOME FOUNDATION LIMITED (GB) 1979-09-05 EP disclosed
US-4017631-A MICROBIOCIDES JANSSEN PHARMACEUTICA N.V. (BE) 1977-04-12 US disclosed
US-3991202-A ANTIMICROBIALS JANSSEN PHARMACEUTICA N.V. (BE) 1976-11-09 US disclosed