SCHEMBL8469077

SCHEMBL8469077

CCCCC(CC)CSP(O)(=S)S

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 5/20 0.38
TSHR P16473 4/20 0.38
CA2 P00918 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
FDPS P14324 1/20 0.34
ATM Q13315 1/20 0.34
LMNA P02545 2/20 0.31
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
HIF1A Q16665 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
SCHEMBL8467900 0.85 ALDH1A1 (0.47) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL4446174 0.85 ALDH1A1 (0.47) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL8468671 0.85 ALDH1A1 (0.42) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL27296353 0.84 ALDH1A1 (0.45) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL27324354 0.84 ALDH1A1 (0.45) ALDH1A1TDP1CYP3A4TSHRCA2
Phosphine SCHEMBL27074301 0.84 ALDH1A1 (0.45) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL15153014 0.84 ALDH1A1 (0.45) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL7539306 0.82 CYP3A4 (0.44) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL9231485 0.81 ALDH1A1 (0.45) ALDH1A1TDP1CYP3A4TSHRCA2
Tetramethylammonium Ion SCHEMBL27680774 0.81 ALDH1A1 (0.42) ALDH1A1TDP1CYP3A4TSHRCA2

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-5942470-A OIL SOLUBLE SULFUR CONTAINING PRESSURE AND ANTI-WEAR AGENT, AMINE SALT OF PHOSPHORUS ESTER, SUCCINIMIDE, AND ASHLESS DISPERSANTS ETHYL PETROLEUM ADDITIVES, INC. (US) 1999-08-24 US disclosed
EP-0459656-B1 Lubricant compositions ETHYL PETROLEUM ADDITIVES INC (US) 1995-09-20 EP disclosed
EP-0459656-A1 Lubricant compositions ETHYL PETROLEUM ADDITIVES, INC. (US) 1991-12-04 EP disclosed