SCHEMBL9367755

SCHEMBL9367755

CC(C)=CCCC(C)=CCOC(Cn1ccnc1)c1ccccc1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 11/20 0.40
CYP2C9 P11712 5/20 0.39
LMNA P02545 3/20 0.39
CYP1A2 P05177 3/20 0.39
CYP3A4 P08684 3/20 0.39
CYP2D6 P10635 3/20 0.39
CYP2C19 P33261 3/20 0.39
MEN1 O00255 2/20 0.39
ALOX15 P16050 2/20 0.39
TSHR P16473 2/20 0.39
KMT2A Q03164 2/20 0.39
NR1I2 O75469 2/20 0.36
NR3C1 P04150 2/20 0.36
CYP17A1 P05093 2/20 0.36
PGR P06401 2/20 0.36
ADRB1 P08588 2/20 0.36
ADORA3 P0DMS8 2/20 0.36
DRD2 P14416 2/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36

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
SCHEMBL9367743 1.00 IDO1 (0.40) IDO1CYP2C9LMNACYP1A2CYP3A4
SCHEMBL9366353 0.83 CYP19A1 (0.45) IDO1CYP2C9LMNACYP1A2CYP3A4
SCHEMBL9366348 0.83 CYP19A1 (0.45) IDO1CYP2C9LMNACYP1A2CYP3A4
SCHEMBL9363361 0.82 LMNA (0.41) IDO1CYP2C9LMNACYP1A2CYP3A4
SCHEMBL9362738 0.79 IDO1 (0.65) IDO1CYP2C9LMNACYP1A2CYP3A4
SCHEMBL9821450 0.79 IDO1 (0.65) IDO1CYP2C9LMNACYP1A2CYP3A4
SCHEMBL9363001 0.79 IDO1 (0.65) IDO1CYP2C9LMNACYP1A2CYP3A4
SCHEMBL9821457 0.79 IDO1 (0.65) IDO1CYP2C9LMNACYP1A2CYP3A4
SCHEMBL3762407 0.79 IDO1 (0.65) IDO1CYP2C9LMNACYP1A2CYP3A4
SCHEMBL9362735 0.79 IDO1 (0.65) IDO1CYP2C9LMNACYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0427242-B1 Azole derivatives and antifungal drugs containing the same as an active component KAO CORP (JP) 1994-09-21 EP disclosed
US-5183824-A Azole derivatives and antifungal drugs containing the same as an active component KAO CORPORATION (JP) 1993-02-02 US disclosed
US-5110826-A AZOLE DERIVATIVES AND ANTIFUNGAL DRUGS CONTAINING THE SAME AS AN ACTIVE COMPONENT KAO CORPORATION (JP) 1992-05-05 US disclosed
EP-0427242-A1 Azole derivatives and antifungal drugs containing the same as an active component KAO CORPORATION (JP) 1991-05-15 EP disclosed