SCHEMBL29003133

SCHEMBL29003133

CSc1nc(N2CCN(C(=O)O)CC2C)ncc1Cl

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 1/20 0.40
MMP2 P08253 1/20 0.36
GPR119 Q8TDV5 10/20 0.35
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GRM1 Q13255 2/20 0.34
SMO Q99835 1/20 0.33
ACACB O00763 3/20 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
SCHEMBL29003128 1.00 SLC6A7 (0.40) SLC6A7MMP2GPR119ALDH1A1MEN1
SCHEMBL29003137 0.85 JAK3 (0.33) ALDH1A1MEN1KMT2ASMO
SCHEMBL29003135 0.85 JAK3 (0.33) ALDH1A1MEN1KMT2ASMO
SCHEMBL24348655 0.85 GPR119 (0.52) GPR119
SCHEMBL29412832 0.85 GPR119 (0.52) GPR119
SCHEMBL24348651 0.85 GPR119 (0.52) GPR119
SCHEMBL29003181 0.81 GPR119 (0.42) SLC6A7MMP2GPR119ALDH1A1
SCHEMBL29003177 0.81 GPR119 (0.42) SLC6A7MMP2GPR119ALDH1A1
SCHEMBL5476032 0.75 SLC6A7 (0.49) SLC6A7GPR119GRM1SMO
SCHEMBL16822 0.75 SLC6A7 (0.49) SLC6A7GPR119GRM1SMO

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
CN-116157122-A Imidazo [1,2-a ] pyridine compounds and their use in therapy 帝国理工学院创新有限公司 2023-05-23 CN disclosed