SCHEMBL1264053

SCHEMBL1264053

C[CH]c1ccccc1OCCl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
HPGD P15428 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HTT P42858 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.38
KDM4E B2RXH2 3/20 0.36
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
CDK4 P11802 2/20 0.36
CCND1 P24385 2/20 0.36
CCNB2 O95067 1/20 0.36
CDK1 P06493 1/20 0.36
CCNB1 P14635 1/20 0.36
CCNB3 Q8WWL7 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 4/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

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
SCHEMBL3016681 0.81 ALDH1A1 (0.52) ALDH1A1HPGDSMN1; SMN2HTTKDM4E
SCHEMBL3200496 0.79 ALDH1A1 (0.50) ALDH1A1HPGDSMN1; SMN2HTTKDM4E
SCHEMBL1702450 0.79 ALDH1A1 (0.45) ALDH1A1HPGDSMN1; SMN2HTTPTGDR2
SCHEMBL4049272 0.79 ALDH1A1 (0.73) ALDH1A1HPGDSMN1; SMN2HTTPTGDR2
SCHEMBL27823276 0.78 ALDH1A1 (0.53) ALDH1A1HPGDSMN1; SMN2HTTPTGDR2
SCHEMBL3199007 0.78 CYP1A2 (0.58) ALDH1A1HPGDSMN1; SMN2HTTMAPT
SCHEMBL7690167 0.77 KDM4E (0.46) ALDH1A1HPGDSMN1; SMN2HTTKDM4E
SCHEMBL6417637 0.76 ALDH1A1 (0.42) ALDH1A1HPGDSMN1; SMN2HTTPTGDR2
SCHEMBL3041547 0.76 CCNB2 (0.62) ALDH1A1HPGDHTTKDM4EPOLB
SCHEMBL677507 0.76 CYP1A2 (0.52) ALDH1A1HPGDSMN1; SMN2HTTTSHR

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
US-20110033804-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-02-10 US disclosed
US-7001706-B2 Sulfonate and a resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-02-21 US disclosed
US-20050014095-A1 Sulfonate and a resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-01-20 US disclosed