SCHEMBL7915327

SCHEMBL7915327

Oc1ccc2ccc3cccc(O)c3c2c1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 3/20 0.67
ALDH1A1 P00352 5/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
DNMT1 P26358 1/20 0.54
CACNA1B Q00975 1/20 0.54
APBA1 Q02410 1/20 0.54
MCL1 Q07820 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
HPGD P15428 5/20 0.50
HSD17B10 Q99714 5/20 0.50
ALOX15 P16050 4/20 0.50
RECQL P46063 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
LMNA P02545 2/20 0.50
ADAMTS4 O75173 1/20 0.50
EGFR P00533 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
FYN P06241 1/20 0.50

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
SCHEMBL6349397 0.93 CDK2 (0.69) CDK2ALDH1A1MEN1KMT2ADNMT1
SCHEMBL31037125 0.93 CDK2 (0.69) CDK2ALDH1A1MEN1KMT2ADNMT1
SCHEMBL7126508 0.87 ALDH1A1 (0.59) CDK2ALDH1A1MEN1KMT2ADNMT1
SCHEMBL193772 0.80 CDK2 (1.00) CDK2ALDH1A1MEN1KMT2ADNMT1
SCHEMBL29363189 0.79 ALDH1A1 (0.62) CDK2ALDH1A1MEN1KMT2ADNMT1
SCHEMBL70219 0.79 ALDH1A1 (0.62) CDK2ALDH1A1MEN1KMT2ADNMT1
SCHEMBL18068453 0.78 CDK2 (0.52) CDK2ALDH1A1MEN1KMT2ADNMT1
SCHEMBL19202197 0.77 CDK2 (0.57) CDK2ALDH1A1MEN1KMT2ADNMT1
SCHEMBL2981975 0.77 CDK2 (0.57) CDK2ALDH1A1MEN1KMT2ADNMT1
SCHEMBL22444700 0.77 CDK2 (0.57) CDK2ALDH1A1MEN1KMT2ADNMT1

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-6207838-B1 ELECTROLYSIS IN LIQUID SULFUR DIOXIDE THE UNIVERSITY OF ARIZONA 2001-03-27 US disclosed
EP-1048752-A2 Electrochemically generated organothiating reagents and their use ALBEMARLE CORPORATION (US) 2000-11-02 EP disclosed
US-4487975-A Etherification of phenols RHONE-POULENC INDUSTRIES (FR) 1984-12-11 US disclosed