SCHEMBL29140107

SCHEMBL29140107

O=C(c1ccc(F)cc1)c1c(-c2ccc(F)cc2)[c]c2ccccn12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.44
▸ KMT2A Q03164 6/20 0.44
▸ MAPT P10636 7/20 0.40
▸ LMNA P02545 3/20 0.40
▸ HTT P42858 2/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ POLB P06746 4/20 0.38
▸ GAA P10253 1/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ NOD2 Q9HC29 1/20 0.37
▸ ALOX15 P16050 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36

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
SCHEMBL29059891 0.76 ALDH1A1 (0.43) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL1380292 0.70 SRD5A2 (0.44) MEN1KMT2AMAPTHTTMAPK1
SCHEMBL28222883 0.68 POLB (0.54) MEN1KMT2AMAPTLMNAHTT
SCHEMBL3296771 0.65 BCL2L1 (0.65) MEN1KMT2AMAPTLMNAHTT
SCHEMBL7937415 0.65 LMNA (0.67) MEN1KMT2AMAPTLMNAHTT
SCHEMBL10513615 0.65 LMNA (0.67) MEN1KMT2AMAPTLMNAHTT
SCHEMBL1864175 0.64 BCL2L1 (0.70) MEN1KMT2AMAPTLMNAHTT
SCHEMBL9777084 0.64 BCL2L1 (0.70) MEN1KMT2AMAPTLMNAHTT
SCHEMBL9814506 0.64 BCL2L1 (0.70) MEN1KMT2AMAPTLMNAHTT
SCHEMBL9937249 0.64 MAPT (0.53) MEN1KMT2AMAPTLMNAHTT

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-114671868-B Polysubstituted indolizine compound containing pyridone and preparation method and application thereof 浙大城市学院 2023-03-31 — — CN disclosed
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