SCHEMBL8724287

SCHEMBL8724287

CCCCCC1CCC(C)(C2(C(=O)O)CCCCC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.41
TP53 P04637 1/20 0.36
PKM P14618 1/20 0.36
MAPT P10636 1/20 0.35
MEN1 O00255 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
SIGMAR1 Q99720 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
GPR119 Q8TDV5 1/20 0.34
CCR2 P41597 1/20 0.33
ALOX5 P09917 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
SCHEMBL8729475 0.89 CYP1A2 (0.32) CYP1A2MAPTMEN1KMT2ASIGMAR1
SCHEMBL10435336 0.89 CYP1A2 (0.44) CYP1A2TP53PKMMAPTMEN1
SCHEMBL10435170 0.88 CYP1A2 (0.43) CYP1A2TP53PKMMAPTMEN1
SCHEMBL10435171 0.88 CYP1A2 (0.43) CYP1A2TP53PKMMAPTMEN1
SCHEMBL10435379 0.88 CYP1A2 (0.43) CYP1A2TP53PKMMAPTMEN1
SCHEMBL10435377 0.88 CYP1A2 (0.43) CYP1A2TP53PKMMAPTMEN1
SCHEMBL10434992 0.88 CYP1A2 (0.43) CYP1A2TP53PKMMAPTMEN1
SCHEMBL9797584 0.87 CYP1A2 (0.50) CYP1A2TP53PKMMAPTMEN1
SCHEMBL10435376 0.84 CYP1A2 (0.50) CYP1A2TP53PKMMAPTMEN1
SCHEMBL10435375 0.78 CYP1A2 (0.35) CYP1A2MAPTMEN1KMT2ASIGMAR1

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-5833879-A LOW TEMPERATURE MISCIBILITY AND COMPATIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS; DISPLAYS CONTAINING MIXTURES OF AT LEAST TWO COMPOUNDS, PHYSICAL PROPERTIES CHISSO CORPORATION (JP) 1998-11-10 US disclosed