SCHEMBL9770228

SCHEMBL9770228

CCCC[CH]Oc1ccc(C(C)(C)CC)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.36
PPARD Q03181 2/20 0.36
PPARA Q07869 2/20 0.36
PPARG P37231 1/20 0.36
CYP2C19 P33261 1/20 0.36
SMN1; SMN2 Q16637 7/20 0.35
MAPK1 P28482 6/20 0.35
NPSR1 Q6W5P4 5/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 5/20 0.35
HTT P42858 3/20 0.35
UBE2N P61088 2/20 0.35
GLA P06280 2/20 0.35
MITF O75030 1/20 0.35
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
LMNA P02545 1/20 0.33
CASP3 P42574 1/20 0.33

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
SCHEMBL9769331 0.89 CNR2 (0.44) CNR1CNR2
SCHEMBL9769326 0.89 SMN1; SMN2 (0.36) CYP2C19SMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL9769309 0.85 CNR2 (0.36) ACACBPPARDPPARAPPARGCYP2C19
SCHEMBL5394859 0.84 MAPK1 (0.47) PPARGSMN1; SMN2MAPK1NPSR1MEN1
SCHEMBL7454444 0.80 MAPK1 (0.45) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL10741308 0.79 TDP1 (0.47) SMN1; SMN2MAPK1MEN1KMT2AALDH1A1
SCHEMBL9770233 0.78 SMN1; SMN2 (0.49) ACACBPPARDPPARAPPARGCYP2C19
SCHEMBL8089131 0.75 MAPK1 (0.49) PPARGSMN1; SMN2MAPK1NPSR1MEN1
SCHEMBL9770022 0.73 MAPK1 (0.34) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL10908204 0.72 MAPT (0.35) PPARGCYP2C19MAPK1NPSR1MAPT

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
US-5019490-A Chlorotrifluoroethylene Polymer FUJI PHOTO FILM CO., LTD. (JP) 1991-05-28 US disclosed