SCHEMBL10635646

SCHEMBL10635646

CC/C(=C\c1ccc(NC(=O)C(C)(C)CCCOc2cc(C)c(OC)cc2C)cc1)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 5/20 0.40
▸ TSHR P16473 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ TTR P02766 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C8 P10632 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ ADRA1A P35348 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ HTR2B P41595 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ SLCO1B3 Q9NPD5 1/20 0.40
▸ CISD1 Q9NZ45 1/20 0.40
▸ SLCO1B1 Q9Y6L6 1/20 0.40
▸ PSEN1 P49768 1/20 0.39
▸ PSEN2 P49810 1/20 0.39
▸ APH1B Q8WW43 1/20 0.39
▸ NCSTN Q92542 1/20 0.39
▸ APH1A Q96BI3 1/20 0.39

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
SCHEMBL10635650 1.00 PPARA (0.40) PPARATSHRTDP1TTRCYP1A2
SCHEMBL10638563 0.92 PPARA (0.40) PPARATSHRTDP1TTRCYP1A2
SCHEMBL10638582 0.92 PPARA (0.40) PPARATSHRTDP1TTRCYP1A2
SCHEMBL10635807 0.89 PPARA (0.41) PPARATSHRTDP1TTRCYP1A2
SCHEMBL10635836 0.89 PPARA (0.41) PPARATSHRTDP1TTRCYP1A2
SCHEMBL10635736 0.89 PPARA (0.55) PPARATSHRTDP1TTRCYP1A2
SCHEMBL10635715 0.89 PPARA (0.55) PPARATSHRTDP1TTRCYP1A2
SCHEMBL10638443 0.84 KDM4E (0.47) PPARATSHRTDP1TTRCYP1A2
SCHEMBL10638439 0.84 KDM4E (0.47) PPARATSHRTDP1TTRCYP1A2
SCHEMBL10641520 0.82 PPARA (0.49) PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0134337-B1 SUBSTITUTED 2,2-DIMETHYL-5-PHENOXYPENTANOIC ACID BENZAMIDES AND THEIR PRODUCTION WARNER-LAMBERT COMPANY (US) 1988-01-07 — — EP claimed
Send feedback