SCHEMBL7774397

SCHEMBL7774397

CSc1cc(=O)c2ccc(CO)cc2s1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.36
PARP1 P09874 1/20 0.34
STS P08842 1/20 0.34
CA2 P00918 2/20 0.33
APP P05067 2/20 0.33
ALDH1A1 P00352 5/20 0.33
ALOX15 P16050 2/20 0.33
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MIF P14174 1/20 0.31
LIMK1 P53667 1/20 0.31
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
CA12 O43570 1/20 0.30
CA3 P07451 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30
CA5A P35218 1/20 0.30
CA7 P43166 1/20 0.30

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
SCHEMBL7774088 0.80 ALDH1A1 (0.39) HSD17B10CA2ALDH1A1ALOX15GAA
SCHEMBL7774018 0.76 ALDH1A1 (0.41) ALDH1A1LMNASMN1; SMN2MIFHTT
SCHEMBL7774411 0.76 PARP1 (0.36) HSD17B10PARP1STSCA2APP
SCHEMBL7775951 0.76 STS (0.41) PARP1STSALDH1A1LMNAGAA
SCHEMBL7769690 0.74 TSHR (0.48) HSD17B10ALDH1A1ALOX15LMNAGAA
SCHEMBL7777262 0.73 MAPT (0.43) HSD17B10PARP1MIFCA12CA9
SCHEMBL9016603 0.72 GPR35 (0.41) HSD17B10ALDH1A1ALOX15HPGDHTT
SCHEMBL13520159 0.69 LIMK1 (0.44) HSD17B10PARP1CA2APPMIF
SCHEMBL7774232 0.67 MAPT (0.43) ALDH1A1ALOX15GAASMN1; SMN2PKM
SCHEMBL19155499 0.66 LIMK1 (0.42) HSD17B10PARP1CA2APPMIF

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-6294527-B1 ANTIBIOTICS FOR METHACILLIN RESISTANT BACTERIA ZENYAKU KOGYO KABUSHIKI KAISHA (JP) 2001-09-25 US disclosed
EP-0949262-B1 CEPHEM COMPOUNDS ZENYAKU KOGYO KK (JP) 2001-08-22 EP disclosed
EP-0949262-A1 CEPHEM COMPOUNDS ZENYAKU KOGYO KABUSHIKIKAISHA (JP) 1999-10-13 EP disclosed