SCHEMBL8937121

SCHEMBL8937121

CCc1cc(=O)[nH]c(F)n1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.48
BACE1 P56817 1/20 0.44
FABP4 P15090 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
PKM P14618 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 1/20 0.41
ADCY8 P40145 3/20 0.40
NAMPT P43490 1/20 0.39
ADCY1 Q08828 2/20 0.39
HTR2B P41595 1/20 0.38

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
SCHEMBL15107929 0.78 SMN1; SMN2 (0.69) LMNAALDH1A1POLBBACE1FABP4
SCHEMBL6998274 0.76 LMNA (0.47) LMNAALDH1A1POLBBACE1FABP4
SCHEMBL2403638 0.76 BACE1 (0.73) LMNAALDH1A1POLBBACE1FABP4
SCHEMBL25350548 0.73 PKM (0.68) LMNAALDH1A1POLBSMN1; SMN2PKM
Benzene SCHEMBL8508944 0.73 BACE1 (0.69) LMNAALDH1A1POLBBACE1FABP4
SCHEMBL1895087 0.73 BACE1 (0.54) LMNAALDH1A1BACE1SMN1; SMN2CYP1A2
SCHEMBL18701579 0.73 LMNA (0.49) LMNAALDH1A1POLBBACE1FABP4
SCHEMBL25346762 0.72 GAA (0.61) LMNAALDH1A1POLBBACE1FABP4
SCHEMBL1893581 0.71 GPR84 (0.59) LMNABACE1FABP4SMN1; SMN2CYP1A2
SCHEMBL8677240 0.69 POLB (0.70) POLBSMN1; SMN2PKMTDP1

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-5567817-A Triazole antifungal agents PFIZER INC. (US) 1996-10-22 US disclosed