SCHEMBL31436032

SCHEMBL31436032

Cc1cc(=O)[nH]c(Nc2nc3ccccc3[nH]2)n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.67
RAB9A P51151 5/20 0.67
SMN1; SMN2 Q16637 4/20 0.67
MAPT P10636 3/20 0.67
KMT2A Q03164 5/20 0.61
MEN1 O00255 4/20 0.61
TAAR1 Q96RJ0 1/20 0.53
NCOA1 Q15788 1/20 0.53
NCOA3 Q9Y6Q9 1/20 0.53
RECQL P46063 1/20 0.52
GAA P10253 2/20 0.51
POLB P06746 1/20 0.51
LMNA P02545 2/20 0.50
HTT P42858 1/20 0.50
MAPK1 P28482 2/20 0.49
TP53 P04637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
ALOX15 P16050 1/20 0.49

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
SCHEMBL28050241 0.80 RAB9A (0.68) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL28728369 0.79 RAB9A (0.66) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL20394892 0.78 SMN1; SMN2 (0.57) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL9879486 0.76 KMT2A (1.00) NPC1SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL824423 0.72 RAB9A (0.75) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL5695259 0.72 GAA (0.67) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL5695193 0.72 NPC1 (0.60) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6037544 0.72 MEN1 (0.71) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL18236256 0.72 AKR1C3 (0.63) NPC1RAB9ASMN1; SMN2MAPTKMT2A
Hydrochloric Acid SCHEMBL5695260 0.71 GAA (0.65) NPC1RAB9ASMN1; SMN2MAPTKMT2A

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-119874685-A Shearing inhibitor for pre-miR-21 post-transcriptional processing and preparation method and application thereof 广东工业大学 2025-04-25 CN disclosed