SCHEMBL11261519

SCHEMBL11261519

CCC(O)c1cc2ccccc2cc1C(O)CC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
UGT2B7 P16662 1/20 0.42
PDE2A O00408 1/20 0.42
CYP2D6 P10635 5/20 0.41
CYP1A2 P05177 3/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
AOC3 Q16853 1/20 0.41
HIF1A Q16665 1/20 0.41
CYP2A6 P11509 1/20 0.40
HSD17B10 Q99714 1/20 0.39
PPARG P37231 4/20 0.39
PPARA Q07869 4/20 0.39
PTPRC P08575 1/20 0.37
PTPRF P10586 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPRB P23467 1/20 0.37
PTPRE P23469 1/20 0.37
PTPN6 P29350 1/20 0.37

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
SCHEMBL11278409 0.85 LMNA (0.42) LMNAUGT2B7PDE2ACYP2D6CYP1A2
SCHEMBL22288132 0.81 LMNA (0.42) LMNAUGT2B7PDE2ACYP2D6CYP1A2
SCHEMBL5107130 0.80 LMNA (0.61) LMNAPDE2ACYP2D6TSHRAOC3
SCHEMBL5107136 0.80 LMNA (0.61) LMNAPDE2ACYP2D6TSHRAOC3
SCHEMBL30172716 0.80 LMNA (0.61) LMNAPDE2ACYP2D6TSHRAOC3
SCHEMBL5107133 0.80 LMNA (0.61) LMNAPDE2ACYP2D6TSHRAOC3
SCHEMBL10120474 0.77 UGT2B7 (0.62) LMNAUGT2B7CYP2D6CYP1A2TSHR
SCHEMBL3929537 0.77 CYP2C9 (0.50) LMNACYP1A2TSHRKMT2AAOC3
SCHEMBL483715 0.77 UGT2B7 (0.62) LMNAUGT2B7CYP2D6CYP1A2TSHR
SCHEMBL3418792 0.77 CYP2C9 (0.50) LMNACYP1A2TSHRKMT2AAOC3

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-4351842-A N-Cyclopropylisoindolines GLAXO LABORATORIES LIMITED (GB) 1982-09-28 US disclosed