SCHEMBL9516172

SCHEMBL9516172

FC(F)(F)c1ccc(P(Cc2ccccc2CP(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
KIF11 P52732 4/20 0.43
CYBB P04839 1/20 0.39
NOX3 Q9HBY0 1/20 0.39
NOX4 Q9NPH5 1/20 0.39
NOX1 Q9Y5S8 1/20 0.39
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 1/20 0.38
TRPV6 Q9H1D0 2/20 0.37
GRIN2B Q13224 2/20 0.36
KCNJ5 P48544 1/20 0.36
KCNJ3 P48549 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
IDO1 P14902 1/20 0.34
BACE1 P56817 1/20 0.34
CYP1A1 P04798 1/20 0.34
MAOB P27338 1/20 0.34
CYP1B1 Q16678 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
SCHEMBL5509956 0.79 CNR2 (0.35) ALDH1A1TSHRKIF11SLC6A4MAPT
SCHEMBL15671664 0.78 ALDH1A1 (0.48) ALDH1A1TSHRKIF11TRPV6GRIN2B
SCHEMBL15658501 0.76 ALDH1A1 (0.42) ALDH1A1TSHRKIF11TRPV6TAAR1
SCHEMBL15732397 0.76 ALDH1A1 (0.42) ALDH1A1TSHRKIF11TRPV6TAAR1
SCHEMBL29387119 0.75 CYP3A4 (0.43)
SCHEMBL244078 0.75 CYP3A4 (0.43)
SCHEMBL10414094 0.73 CYP3A4 (0.41)
SCHEMBL9518313 0.73 CYP3A4 (0.41)
SCHEMBL15658982 0.72 TAAR1 (0.39) ALDH1A1TSHRKIF11SLC6A3TRPV6
SCHEMBL8416641 0.72 TAAR1 (0.39) ALDH1A1TSHRKIF11TRPV6TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0375573-B1 LOW PRESSURE RHODIUM CATALYZED HYDROFORMYLATION OF OLEFINS EASTMAN KODAK COMPANY (US) 1993-03-17 EP claimed
EP-0449966-A1 LOW PRESSURE RHODIUM CATALYZED HYDROFORMYLATION OF OLEFINS EASTMAN KODAK COMPANY (US) 1991-10-09 EP claimed
US-5004823-A Complex with bidentate ligand; catalyst selectivity EASTMAN KODAK COMPANY (US) 1991-04-02 US claimed
US-4960949-A RHODIUM-PHOSPHINE COMPLEX; HIGH SELECTIVITY EASTMAN KODAK COMPANY (US) 1990-10-02 US claimed
WO-1990006810-A1 LOW PRESSURE RHODIUM CATALYZED HYDROFORMYLATION OF OLEFINS EASTMAN KODAK COMPANY (US) 1990-06-28 WO claimed
EP-0375573-A1 Low pressure rhodium catalyzed hydroformylation of olefins EASTMAN KODAK COMPANY (US) 1990-06-27 EP claimed
EP-0375573-B1 LOW PRESSURE RHODIUM CATALYZED HYDROFORMYLATION OF OLEFINS EASTMAN KODAK COMPANY (US) 1993-03-17 EP disclosed
EP-0449966-A1 LOW PRESSURE RHODIUM CATALYZED HYDROFORMYLATION OF OLEFINS EASTMAN KODAK COMPANY (US) 1991-10-09 EP disclosed
US-5004823-A Complex with bidentate ligand; catalyst selectivity EASTMAN KODAK COMPANY (US) 1991-04-02 US disclosed
US-4960949-A RHODIUM-PHOSPHINE COMPLEX; HIGH SELECTIVITY EASTMAN KODAK COMPANY (US) 1990-10-02 US disclosed
WO-1990006810-A1 LOW PRESSURE RHODIUM CATALYZED HYDROFORMYLATION OF OLEFINS EASTMAN KODAK COMPANY (US) 1990-06-28 WO disclosed
EP-0375573-A1 Low pressure rhodium catalyzed hydroformylation of olefins EASTMAN KODAK COMPANY (US) 1990-06-27 EP disclosed