SCHEMBL17124807

SCHEMBL17124807

Cc1ccc(C)c(OCCCCOCCCCOCCCCO)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.59
CYP2C9 P11712 2/20 0.52
PPARA Q07869 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
TTR P02766 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C8 P10632 1/20 0.52
CHRM1 P11229 1/20 0.52
ADRA1A P35348 1/20 0.52
PPARG P37231 1/20 0.52
HTR2B P41595 1/20 0.52
SLCO1B3 Q9NPD5 1/20 0.52
CISD1 Q9NZ45 1/20 0.52
SLCO1B1 Q9Y6L6 1/20 0.52
HTT P42858 2/20 0.48
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HPGD P15428 1/20 0.47

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
SCHEMBL15871994 0.95 TSHR (0.65) TSHRCYP2C9PPARATDP1SMN1; SMN2
SCHEMBL8302732 0.90 TSHR (0.67) TSHRCYP2C9PPARATDP1SMN1; SMN2
SCHEMBL17124806 0.85 TSHR (0.57) TSHRCYP2C9PPARATDP1SMN1; SMN2
SCHEMBL10111043 0.85 TSHR (0.57) TSHRCYP2C9PPARATDP1SMN1; SMN2
SCHEMBL516010 0.84 TSHR (0.64) TSHRCYP2C9PPARATDP1SMN1; SMN2
SCHEMBL5266458 0.82 TSHR (0.70) TSHRCYP2C9PPARATDP1SMN1; SMN2
SCHEMBL30292305 0.81 L3MBTL4 (0.53) TSHRCYP2C9TDP1SMN1; SMN2CYP1A2
SCHEMBL5929495 0.80 TSHR (0.67) TSHRCYP2C9PPARATDP1SMN1; SMN2
SCHEMBL8955686 0.79 ALDH1A1 (0.50) TSHRSMN1; SMN2HTTALDH1A1KDM4E
SCHEMBL13475545 0.79 TSHR (0.62) TSHRCYP2C9PPARATDP1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9758688-B2 Composition for forming conductive film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-09-12 US disclosed
US-20150275015-A1 COMPOSITION FOR FORMING CONDUCTIVE FILM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-01 US disclosed