SCHEMBL9623875

SCHEMBL9623875

CCCCCC(CC)CCS(=O)(=O)CCC(CC)CCCCC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.45
CA2 P00918 3/20 0.42
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 1/20 0.41
CYP3A4 P08684 3/20 0.40
TSHR P16473 2/20 0.40
OPRM1 P35372 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
FAAH O00519 2/20 0.37
RECQL P46063 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
ATM Q13315 1/20 0.35
FDPS P14324 1/20 0.34
SMPD1 P17405 1/20 0.34

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
SCHEMBL9623132 0.93 CA2 (0.48) TP53CA2ALDH1A1TDP1CYP3A4
SCHEMBL8813253 0.85 TP53 (0.44) TP53CA2ALDH1A1TDP1LMNA
SCHEMBL23666683 0.84 CA2 (0.42) TP53CA2LMNAOPRM1FAAH
SCHEMBL8813255 0.83 TP53 (0.52) TP53CA2ALDH1A1TDP1LMNA
SCHEMBL28409630 0.82 TP53 (0.50) TP53CA2ALDH1A1TDP1LMNA
SCHEMBL28338902 0.82 TP53 (0.50) TP53CA2ALDH1A1TDP1LMNA
SCHEMBL5961183 0.81 GCLC (0.36) CA2
SCHEMBL1094064 0.81 ALDH1A1 (0.52) TP53CA2ALDH1A1TDP1LMNA
SCHEMBL252431 0.81 ALDH1A1 (0.57) TP53CA2ALDH1A1TDP1LMNA
SCHEMBL20223453 0.78 CA2 (0.47) TP53CA2ALDH1A1TDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5110902-A High molecular weight polythioether-sulfones PHILLIPS PETROLEUM COMPANY (US) 1992-05-05 US disclosed
US-5086163-A High molecular weight polymers formed by contacting dihaloaromatic sulfone with complex of alkali metal aminoalkanoate and alkalimetal hydrosulfide PHILLIPS PETROLEUM COMPANY (US) 1992-02-04 US disclosed
US-5015725-A Heat resistant thermoplastic resins for electrical components, aircraft or automobile parts, protective coatings PHILLIPS PETROLEUM COMPANY (US) 1991-05-14 US disclosed
EP-0309955-A1 Aromatic sulfide/sulfone polymer production PHILLIPS PETROLEUM COMPANY (US) 1989-04-05 EP disclosed
US-4125525-A Aromatic sulfide/sulfone polymer production PHILLIPS PETROLEUM COMPANY (US) 1978-11-14 US disclosed