SCHEMBL31389239

SCHEMBL31389239

O=C(O)c1cc(OCc2ccc(Cl)cc2)c2ccccc2n1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.57
PTGER1 P34995 7/20 0.52
MAPT P10636 3/20 0.51
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
RHEB Q15382 2/20 0.50
MRGPRX4 Q96LA9 2/20 0.47

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
SCHEMBL31389237 0.91 ALOX15 (0.64) ALOX15PTGER1HTTSMN1; SMN2MRGPRX4
SCHEMBL2908552 0.91 ALOX15 (0.64) ALOX15PTGER1HTTSMN1; SMN2MRGPRX4
SCHEMBL31389245 0.90 GRM2 (0.52) ALOX15PTGER1MAPTLMNAHTT
Hydrochloric Acid SCHEMBL28687342 0.89 ALOX15 (0.62) ALOX15PTGER1HTTSMN1; SMN2MRGPRX4
SCHEMBL31389259 0.88 ALOX15 (0.58) ALOX15
SCHEMBL31389236 0.88 MAPT (0.58) ALOX15MAPTLMNAHTTSMN1; SMN2
SCHEMBL31389294 0.87 ALOX15 (0.57) ALOX15PTGER1MAPTLMNA
SCHEMBL31389261 0.87 ALOX15 (0.57) ALOX15PTGER1MAPTLMNAHTT
SCHEMBL31389252 0.85 ALOX15 (0.65) ALOX15PTGER1MAPTLMNAHTT
SCHEMBL31389232 0.84 ALOX15 (0.56) ALOX15PTGER1L3MBTL1MRGPRX4

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-119264047-A Quinoline derivative histone deacetylase inhibitor and preparation method and application thereof 山东大学 2025-01-07 CN disclosed