SCHEMBL11097622

SCHEMBL11097622

O=Cc1c(Cl)nc(-c2ccccc2)n1Cc1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
LMNA P02545 4/20 0.48
RAB9A P51151 2/20 0.45
RECQL P46063 1/20 0.45
PDE6D O43924 1/20 0.44
ALDH2 P05091 1/20 0.44
ALDH3A1 P30838 1/20 0.44
TP53 P04637 2/20 0.44
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
HPGD P15428 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MAPT P10636 1/20 0.43
GALR3 O60755 1/20 0.43
NR2F2 P24468 1/20 0.43
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL11160756 0.93 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2LMNARAB9ARECQL
SCHEMBL6202033 0.89 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2LMNARAB9ARECQL
SCHEMBL11162148 0.85 LMNA (0.49) ALDH1A1SMN1; SMN2LMNAHPGDMAPT
SCHEMBL11098803 0.81 IDO1 (0.43) ALDH1A1SMN1; SMN2LMNARAB9ARECQL
SCHEMBL11093772 0.81 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2LMNARAB9ARECQL
SCHEMBL11163273 0.81 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2LMNARAB9ARECQL
SCHEMBL7609835 0.80 GP6 (0.42) ALDH1A1SMN1; SMN2
SCHEMBL11095083 0.80 TP53 (0.55) ALDH1A1SMN1; SMN2LMNARAB9ARECQL
SCHEMBL5330186 0.80 AR (0.51) ALDH1A1LMNARAB9AHPGDMAPT
SCHEMBL6229258 0.79 PTGDR2 (0.39) ALDH1A1SMN1; SMN2LMNARAB9ARECQL

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0028834-B1 IMIDAZOLE-5-ACETIC ACID DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1984-01-18 EP disclosed
US-4355040-A Hypotensive imidazole-5-acetic acid derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-10-19 US disclosed
EP-0028834-A1 Imidazole-5-acetic acid derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1981-05-20 EP disclosed