SCHEMBL9503246

SCHEMBL9503246

CCn1nccc1C(=O)c1ccc(O)c(Cl)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
HPGD P15428 1/20 0.47
RAB9A P51151 3/20 0.46
HTT P42858 2/20 0.45
NPC1 O15118 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.35
MAPK1 P28482 2/20 0.33
BCL2L11 O43521 1/20 0.33
BCL2L1 Q07817 1/20 0.33
MCL1 Q07820 1/20 0.33
CYP3A4 P08684 1/20 0.33
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL9745131 0.86 ALDH1A1 (0.35) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10554694 0.84 P2RX7 (0.43) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10400883 0.84 MEN1 (0.48) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL9745466 0.83 MEN1 (0.44) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL9744452 0.81 HTT (0.55) MEN1KMT2AALDH1A1SMN1; SMN2RAB9A
SCHEMBL9502467 0.79 MEN1 (0.52) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL9844351 0.76 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL16963334 0.72 KMT2A (0.55) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL10399119 0.71 MEN1 (0.41) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL9746104 0.71 L3MBTL1 (0.39) MEN1KMT2AALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0414931-B1 HYPOTENSIVE AGENT TANABE SEIYAKU CO (JP) 1993-07-14 EP disclosed
EP-0414931-A1 Hypotensive agent TANABE SEIYAKU CO., LTD. (JP) 1991-03-06 EP disclosed