SCHEMBL11069977

SCHEMBL11069977

O=CCCCCCCCCCCCCCCCCCc1ccc(C(=O)O)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.48
TSHR P16473 1/20 0.45
CASP1 P29466 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PPARG P37231 1/20 0.45
KAT8 Q9H7Z6 2/20 0.44
RARB P10826 3/20 0.41
RARA P10276 1/20 0.41
RARG P13631 1/20 0.41
NR1H4 Q96RI1 1/20 0.40
IGF1R P08069 1/20 0.40
ALOX15 P16050 1/20 0.40
CDK1 P06493 1/20 0.40
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
MEN1 O00255 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 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
SCHEMBL11485420 0.94 TSHR (0.47) PPARATSHRCASP1SMN1; SMN2PPARG
SCHEMBL10898569 0.88 KAT8 (0.48) PPARAPPARGKAT8RARBRARA
SCHEMBL22032180 0.88 TSHR (0.50) PPARATSHRCASP1SMN1; SMN2PPARG
SCHEMBL5539478 0.81 IGF1R (0.54) IGF1RALOX15CDK1MEN1KMT2A
Ammonia Solution, Strong SCHEMBL27670238 0.81 PPARA (0.68) PPARAPPARGKAT8RARBRARA
SCHEMBL11120604 0.81 KAT8 (0.68) PPARACASP1PPARGKAT8IGF1R
SCHEMBL5545868 0.79 IGF1R (0.56) IGF1RALOX15MEN1KMT2APYGL
SCHEMBL22032157 0.77 TSHR (0.49) PPARATSHRCASP1SMN1; SMN2NR1H4
SCHEMBL9952446 0.76 TSHR (0.55) PPARATSHRCASP1SMN1; SMN2NR1H4
SCHEMBL27605961 0.76 TSHR (0.55) PPARATSHRCASP1SMN1; SMN2PPARG

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-0126372-A1 Halogenated protease inhibitors G.D. Searle & Co. (US) 1984-11-28 EP claimed