SCHEMBL9328289

SCHEMBL9328289

Cc1ccc(C(C)(OP(O)Cl)c2ccc(C)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.37
ALDH1A1 P00352 2/20 0.37
POLB P06746 2/20 0.37
CA2 P00918 1/20 0.37
TYR P14679 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.35
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
USP2 O75604 1/20 0.32
HSPA5 P11021 1/20 0.32
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
MAPT P10636 1/20 0.31
KDM4E B2RXH2 1/20 0.30
TP53 P04637 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
SCHEMBL10446441 0.84 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1POLBCA2TYR
SCHEMBL9356123 0.83 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1POLBCA2TYR
SCHEMBL9328182 0.83 ALDH1A1 (0.36) ALDH1A1TYRCYP2C19MAPT
SCHEMBL10442446 0.75 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1POLBCA2TYR
SCHEMBL9328476 0.74 TYR (0.36) TYRPTGS1HTTMAPT
SCHEMBL17594923 0.73 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1POLBCA2TYR
SCHEMBL9330485 0.71 MRGPRX4 (0.36) SMN1; SMN2ALDH1A1POLBCA2TYR
SCHEMBL9329822 0.71 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1POLBCA2TYR
SCHEMBL8390717 0.69 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1CA2TYRPTGS2
SCHEMBL10442447 0.69 USP2 (0.36) SMN1; SMN2ALDH1A1POLBCA2TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0357048-B1 Process for transhalogenating a halophosphorus compound with hydrogen fluoride ALBEMARLE CORP (US) 1994-09-28 EP disclosed
EP-0358985-B1 Method of transhalogenating a halophosphorus compound with fluoride ETHYL CORP (US) 1994-03-16 EP disclosed
EP-0312790-B1 Process for transhalogenating a halophosphorus compound with fluoride ETHYL CORP (US) 1993-11-18 EP disclosed
US-5136075-A Process for transhalogenating a halophosphorus compound with fluoride ETHYL CORPORATION (US) 1992-08-04 US disclosed
US-5061818-A Fluorination with metal or ammonium fluoride in presence of pyridine halide salt ETHYL CORPORATION (US) 1991-10-29 US disclosed
US-5049691-A Process for transhalogenating a halophosphorous compound with anhydrous hydrogen fluoride ETHYL CORPORATION (US) 1991-09-17 US disclosed
US-4929745-A Transhalogenation of halophosphorus compounds EHTYL CORPORATION (US) 1990-05-29 US disclosed
US-4910324-A Using a metal or ammonium fluoride ETHYL CORPORATION (US) 1990-03-20 US disclosed