SCHEMBL7889299

SCHEMBL7889299

CCCCc1ccc(COC(C)O[C]=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 2/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CA2 P00918 2/20 0.39
ESR1 P03372 2/20 0.39
ADRA2A P08913 2/20 0.39
ADORA3 P0DMS8 2/20 0.39
TACR2 P21452 2/20 0.39
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
KDM4E B2RXH2 2/20 0.39
LMNA P02545 2/20 0.39
CYP3A4 P08684 2/20 0.39
HIF1A Q16665 2/20 0.39
SHBG P04278 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL24588701 0.85 ESR1 (0.47) ALDH1A1HSD17B10HPGDSMN1; SMN2NPC1
SCHEMBL7893724 0.81 THRB (0.41) ALDH1A1HSD17B10HPGDSMN1; SMN2NPC1
SCHEMBL96441 0.78 SLC1A3 (0.41) ALDH1A1MAPTMEN1CYP1A2TSHR
SCHEMBL7889300 0.78 ALDH1A1 (0.40) ALDH1A1HSD17B10HPGDSMN1; SMN2NPC1
SCHEMBL2090223 0.76 ALDH1A1 (0.47) ALDH1A1HSD17B10HPGDSMN1; SMN2CA2
SCHEMBL3366003 0.76 TP53 (0.42) ALDH1A1SMN1; SMN2NPC1RAB9ATP53
SCHEMBL6141150 0.74 IDO1 (0.50) SMN1; SMN2NPC1RAB9ACA2LMNA
SCHEMBL5543309 0.73 IDO1 (0.44) SMN1; SMN2NPC1RAB9ASLC6A2SLC6A4
SCHEMBL5542798 0.71 TDP1 (0.44) MAPTTDP1L3MBTL1
SCHEMBL16667812 0.70 ALDH1A1 (0.56) ALDH1A1HSD17B10CA2ESR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6180316-B1 SUITABLE FOR USE AS CHEMICALLY AMPLIFIED RESIST USED IN MANUFACTURING OF INTEGRATED CIRCUITS JSR CORPORATION (JP) 2001-01-30 US disclosed
EP-0930541-A1 Radiation sensitive resin composition JSR Corporation (JP) 1999-07-21 EP disclosed