SCHEMBL27464900

SCHEMBL27464900

COc1ccccc1-c1cccc2nc3ccccc3cc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
HPGD P15428 2/20 0.53
NQO2 P16083 3/20 0.51
LMNA P02545 5/20 0.50
KDM4E B2RXH2 4/20 0.50
GAA P10253 2/20 0.50
TLR8 Q9NR97 1/20 0.50
ADORA2A P29274 1/20 0.50
POLB P06746 3/20 0.49
NPC1 O15118 1/20 0.49
GLA P06280 1/20 0.49
PTBP1 P26599 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
RCE1 Q9Y256 1/20 0.49
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 2/20 0.48
TSHR P16473 2/20 0.48

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
SCHEMBL240664 0.86 NQO2 (0.57) ALDH1A1SMN1; SMN2HPGDNQO2LMNA
Hydrochloric Acid SCHEMBL15271481 0.85 NQO2 (0.56) ALDH1A1SMN1; SMN2HPGDNQO2LMNA
SCHEMBL4014126 0.84 KMT2A (0.64) ALDH1A1SMN1; SMN2HPGDNQO2LMNA
SCHEMBL17941744 0.84 POLB (0.47) ALDH1A1SMN1; SMN2HPGDNQO2LMNA
Hydrochloric Acid SCHEMBL32690198 0.83 NQO2 (0.54) ALDH1A1SMN1; SMN2HPGDNQO2LMNA
SCHEMBL27688450 0.80 NQO1 (0.57) ALDH1A1SMN1; SMN2HPGDNQO2LMNA
SCHEMBL1187275 0.79 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2HPGDNQO2LMNA
SCHEMBL28225353 0.78 ACACA (0.58) ALDH1A1SMN1; SMN2HPGDNQO2LMNA
SCHEMBL28229302 0.78 ALDH1A1 (0.53) ALDH1A1HPGDNQO2LMNAKDM4E
SCHEMBL1187919 0.78 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2HPGDNQO2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101438208-A Photosensitive resin composition ASAHI KASEI EMD CORP (JP) 2009-05-20 CN disclosed
CN-1157819-C Nanaqueous electrolyte battery ������������ʽ���� 2004-07-14 CN disclosed
CN-1298212-A Nanaqueous electrolyte battery SONY CORP (JP) 2001-06-06 CN disclosed