SCHEMBL28223262

SCHEMBL28223262

CCCCC(O)c1c(C(C)(C)C)cc(CN)cc1C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.35
ATM Q13315 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
XBP1 P17861 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TP53 P04637 2/20 0.33
CYP2C9 P11712 2/20 0.33
ALOX15 P16050 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP2D6 P10635 1/20 0.33
HSPA5 P11021 1/20 0.33
ADRB2 P07550 4/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
TSHR P16473 2/20 0.31
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
GMNN O75496 1/20 0.30
GABBR2 O75899 1/20 0.30
CYP1A2 P05177 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
SCHEMBL28173898 0.94 ATM (0.33) GAAATMNPSR1XBP1L3MBTL1
SCHEMBL21753943 0.76 SMN1; SMN2 (0.39) GAAATMNPSR1XBP1L3MBTL1
SCHEMBL27801951 0.72 CYP3A4 (0.34) GAAATMNPSR1XBP1L3MBTL1
SCHEMBL27281688 0.72 ALDH1A1 (0.38) GAAATMNPSR1TP53CYP2C9
SCHEMBL27801953 0.70 S1PR1 (0.38)
SCHEMBL27822657 0.70 S1PR1 (0.38)
SCHEMBL1552298 0.69 ALDH1A1 (0.59) GAAATMNPSR1TP53CYP2C9
SCHEMBL10952281 0.68 HSPA5 (0.50) GAATP53CYP2C9ALOX15CYP2C19
Hydrochloric Acid SCHEMBL8996460 0.67 ALDH1A1 (0.57) GAAATMNPSR1TP53CYP2C9
SCHEMBL9646349 0.67 S1PR2 (0.43) ALOX15ALDH1A1TSHRNFKB1HIF1A

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-108137929-B Resin composition, resin molded article, method for producing resin molded article with plating layer, and method for producing portable electronic device component having antenna 三菱工程塑料株式会社 2019-07-16 CN disclosed
CN-105518180-B Thermoplastic resin composition, synthetic resin and the synthetic resin with plating layer manufacturing method 三菱工程塑料株式会社 2019-02-05 CN disclosed
CN-108137929-A Resin composition, resin molded article, method for producing resin molded article with plating layer, and method for producing portable electronic device component having antenna 三菱工程塑料株式会社 2018-06-08 CN disclosed