SCHEMBL6964824

SCHEMBL6964824

COc1nc2ccccc2cc1NC(=O)Oc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
GAA P10253 3/20 0.51
KDM4E B2RXH2 3/20 0.51
GLA P06280 1/20 0.51
HPGD P15428 1/20 0.51
ATM Q13315 1/20 0.51
MAOB P27338 1/20 0.51
TRPV1 Q8NER1 1/20 0.48
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 6/20 0.46
MEN1 O00255 3/20 0.46
POLB P06746 1/20 0.45
MAPT P10636 3/20 0.44
THRB P10828 1/20 0.44
GFER P55789 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP1A2 P05177 1/20 0.43
RAB9A P51151 2/20 0.43
KIT P10721 1/20 0.42

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
SCHEMBL6956523 0.84 RAB9A (0.40) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL6954161 0.84 MAOB (0.56) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL261957 0.83 MAPT (0.49) ALDH1A1GAAKDM4EHPGDSMN1; SMN2
Benzene SCHEMBL27466605 0.82 ALDH1A1 (0.48) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL6965290 0.82 ALDH1A1 (0.48) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL6560382 0.80 ALDH1A1 (0.50) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL6786224 0.79 POLB (0.57) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL6953240 0.79 KMT2A (0.46) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL6965277 0.79 ALDH1A1 (0.48) ALDH1A1GAAKDM4EGLAHPGD
SCHEMBL17372671 0.78 MAPT (0.53) ALDH1A1GAAKDM4EGLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1152015-C Piperazine devivatives and process for preparation thereof ������ҩ��ʽ���� 2004-06-02 CN disclosed
EP-0850222-B1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARM CO LTD (KR) 2003-05-28 EP disclosed
US-6028195-A AN ANTITUMOR AGENT WITH VERY LOW TOXICITIES SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-02-22 US disclosed
CN-1196724-A Novel piperazine derivative and process for producing the same SAMJIN PHARM CO LTD (KR) 1998-10-21 CN disclosed
EP-0850222-A1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 1998-07-01 EP disclosed
WO-1998000402-A1 PIPERAZINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 1998-01-08 WO disclosed