SCHEMBL14899588

SCHEMBL14899588

C=C(CSCC(=O)O)CSCC(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.71
HIF1A Q16665 1/20 0.71
CYP2C19 P33261 2/20 0.45
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 2/20 0.39
GMNN O75496 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
CYP2C9 P11712 1/20 0.39
BLM P54132 1/20 0.39
BHMT Q93088 1/20 0.35
FABP4 P15090 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
PHGDH O43175 1/20 0.35
GAA P10253 1/20 0.33

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
Ethylene SCHEMBL28577554 0.84 CYP2D6 (0.86) CYP2D6HIF1ACYP2C19ALDH1A1HSD17B10
SCHEMBL144220 0.84
SCHEMBL2034998 0.84 CYP2D6 (1.00) CYP2D6HIF1ACYP2C19ALDH1A1HSD17B10
SCHEMBL13398732 0.82
Ammonia Solution, Strong SCHEMBL28227410 0.81 CYP2D6 (0.92) CYP2D6HIF1ACYP2C19ALDH1A1HSD17B10
SCHEMBL2561049 0.78
SCHEMBL7900335 0.78 CYP2D6 (0.63) CYP2D6HIF1ACYP2C19ALDH1A1HSD17B10
SCHEMBL9034105 0.73
SCHEMBL4118350 0.73
SCHEMBL917864 0.73 CYP2D6 (0.75) CYP2D6HIF1ACYP2C19ALDH1A1HSD17B10

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-11000625-B2 Amplified photodegradation of hydrogels and methods of producing the same THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2021-05-11 US disclosed
US-8431626-B2 Disulfide monomers comprising ethylenically unsaturated norbornyl groups suitable for dental compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-04-30 US disclosed