SCHEMBL28348403

SCHEMBL28348403

CCCCOC(OCCCC)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.42
CYP2D6 P10635 3/20 0.41
CYP3A4 P08684 2/20 0.41
CYP19A1 P11511 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP17A1 P05093 1/20 0.41
LSS P48449 1/20 0.41
PTGES O14684 1/20 0.41
ALOX5 P09917 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
RARB P10826 4/20 0.41
CHRNB2 P17787 2/20 0.40
CHRNA4 P43681 2/20 0.40
HPGD P15428 2/20 0.40
GAA P10253 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40

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
SCHEMBL28346107 0.91 CHRNB2 (0.44) CYP2D6CYP3A4CYP17A1LSSCHRNB2
SCHEMBL10717745 0.89 LTA4H (0.47) LTA4HCYP2D6CYP2C9CYP2C19SMN1; SMN2
SCHEMBL17864870 0.87 SLC2A1 (0.41) LTA4HCYP2D6CYP2C9CYP2C19HPGD
SCHEMBL10761888 0.83 LTA4H (0.47) LTA4HCYP3A4SMN1; SMN2
SCHEMBL11057451 0.81 NPC1 (0.47) LTA4HCYP3A4SMN1; SMN2
SCHEMBL9155398 0.81 NPC1 (0.47) LTA4HCYP3A4SMN1; SMN2
SCHEMBL22311218 0.81 PTGS2 (0.46) CYP17A1CHRNB2CHRNA4L3MBTL1
SCHEMBL16767866 0.81 HTR2A (0.44) LTA4HCYP19A1CYP2C9CYP2C19CYP1A2
SCHEMBL9053497 0.79 MAPT (0.39) PTGESALOX5PPARGPPARASMN1; SMN2
SCHEMBL10584634 0.79 NPC1 (0.49) CYP3A4CYP2C9CYP2C19HPGDSMN1; SMN2

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
CN-117500864-A Curable resin composition, prepreg, and cured product thereof 日本化药株式会社 2024-02-02 CN disclosed
CN-108884212-B Maleimide resin, curable resin composition and cured product thereof 日本化药株式会社 2020-12-29 CN disclosed
CN-110546177-A Maleimide resin composition, prepreg and cured product thereof NIPPON KAYAKU KK 2019-12-06 CN disclosed