SCHEMBL9563396

SCHEMBL9563396

O=COc1ccc2c(c1)Cc1ccccc1-2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
MAPT P10636 3/20 0.49
HPGD P15428 3/20 0.49
KDM4E B2RXH2 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SRD5A2 P31213 1/20 0.47
MAOA P21397 2/20 0.47
HSD17B10 Q99714 1/20 0.43
CYP1A2 P05177 3/20 0.43
HTR2C P28335 2/20 0.43
HTR2B P41595 2/20 0.43
ADRA2A P08913 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
CYP3A4 P08684 2/20 0.41
DRD2 P14416 1/20 0.41
ADRA1D P25100 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
SCHEMBL15497039 0.83 MAPT (0.49) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL18504206 0.78 SRD5A2 (0.58) ALDH1A1MAPTHPGDKDM4ENPC1
SCHEMBL5060829 0.77 NPC1 (0.47) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL29633762 0.77 DRD1 (0.58) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL2914928 0.77 DRD1 (0.58) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL9563395 0.76 MAPT (0.49) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL20484577 0.76 MAPT (0.44) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL2141556 0.75 ALDH1A1 (0.52) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL6797983 0.75 STS (0.56) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2
SCHEMBL2720506 0.74 ALDH1A1 (0.70) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1166704-C Anti-reflection coating polymer and preparing method thereof �ִ����Ӳ�ҵ��ʽ���� 2004-09-15 CN claimed
CN-1260355-A Anti-reflection coating polymer and preparing method thereof HYUNDAI ELECTRONICS IND (KR) 2000-07-19 CN claimed
EP-0556585-A2 Condensed camptothecin derivatives their production and use as antitumor agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-08-25 EP claimed
EP-0556585-A2 Condensed camptothecin derivatives their production and use as antitumor agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-08-25 EP disclosed