SCHEMBL8058024

SCHEMBL8058024

CC1CCC(Nc2ccccc2)(Nc2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NR5A2 O00482 2/20 0.39
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
ALOX12 P18054 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NR5A1 Q13285 1/20 0.36
ACHE P22303 1/20 0.35
GFER P55789 1/20 0.35
TSHR P16473 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
SCHEMBL8042424 0.79 KDM4E (0.41) NR5A2ALDH1A1KDM4EMAPTALOX12
SCHEMBL8060418 0.79 GLA (0.47) NR5A2ALDH1A1KDM4ELMNAMAPT
SCHEMBL29757689 0.75 SMN1; SMN2 (0.43) ALDH1A1LMNAMAPTTDP1TSHR
SCHEMBL8019111 0.74 HTR2B (0.39) ALDH1A1TDP1
SCHEMBL8101425 0.68 OPRM1 (0.50) CYP2C9
SCHEMBL16448226 0.67 TDP1 (0.42) CYP2C9CYP2C19NR5A2ALDH1A1LMNA
SCHEMBL14492212 0.67 SMN1; SMN2 (0.49) ALDH1A1LMNAMAPTALOX12GFER
SCHEMBL14492214 0.67 SMN1; SMN2 (0.49) ALDH1A1LMNAMAPTALOX12GFER
SCHEMBL13503954 0.67 SMN1; SMN2 (0.49) ALDH1A1LMNAMAPTALOX12GFER
SCHEMBL10483788 0.66 CYP1A2 (0.34) CYP2C9CYP2C19NR5A2ALDH1A1LMNA

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
JP-11152332-A None JP disclosed
US-6031067-A Soluble polyimide resin and process of preparation of the same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2000-02-29 US disclosed
JP-H11152332-A NOVEL SOLUBLE POLYIMIDE RESIN KOREA RES INST OF CHEM TECHNOL 1999-06-08 JP disclosed