SCHEMBL29865482

SCHEMBL29865482

O=C(Nc1cccnc1)c1sc2ccccc2c1Cl

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.74
SMN1; SMN2 Q16637 9/20 0.74
NPC1 O15118 9/20 0.74
RAB9A P51151 9/20 0.74
F10 P00742 1/20 0.74
LMNA P02545 3/20 0.73
ALDH1A1 P00352 4/20 0.67
MAPK1 P28482 1/20 0.67
TP53 P04637 2/20 0.63
RXFP1 Q9HBX9 1/20 0.63
KMT2A Q03164 6/20 0.60
GAA P10253 1/20 0.60
KDM4E B2RXH2 3/20 0.59
HPGD P15428 3/20 0.59
HTT P42858 1/20 0.59
HDAC1 Q13547 1/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
MEN1 O00255 4/20 0.58
CASP3 P42574 1/20 0.58

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
SCHEMBL23353332 1.00 MAPT (0.74) MAPTSMN1; SMN2NPC1RAB9AF10
SCHEMBL6592099 0.86 F10 (1.00) SMN1; SMN2NPC1RAB9AF10LMNA
SCHEMBL29865475 0.85 MAPT (1.00) MAPTSMN1; SMN2NPC1RAB9AF10
SCHEMBL23353224 0.85 MAPT (1.00) MAPTSMN1; SMN2NPC1RAB9AF10
SCHEMBL5935569 0.85 MAPT (0.79) MAPTSMN1; SMN2NPC1RAB9AF10
SCHEMBL16384127 0.84 RAB9A (1.00) MAPTSMN1; SMN2NPC1RAB9AF10
SCHEMBL7984436 0.80 GAA (0.85) MAPTSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL6592495 0.79 F10 (0.77) MAPTSMN1; SMN2NPC1RAB9AF10
SCHEMBL11888641 0.79 NPC1 (0.69) MAPTSMN1; SMN2NPC1RAB9ALMNA
SCHEMBL14315172 0.77 MAPT (1.00) MAPTSMN1; SMN2NPC1RAB9AF10

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-115066427-A Compound, organic electroluminescent device and display device SK株式会社 2022-09-16 CN disclosed