SCHEMBL24593233

SCHEMBL24593233

Cc1cc2c3ccccc3[nH]c2c2sc3ccccc3c12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.59
▸ MEN1 O00255 5/20 0.59
▸ KMT2A Q03164 5/20 0.59
▸ RAB9A P51151 2/20 0.59
▸ MAP3K9 P80192 3/20 0.52
▸ MAP3K11 Q16584 3/20 0.52
▸ CDK4 P11802 1/20 0.52
▸ CCND1 P24385 1/20 0.52
▸ TNKS2 Q9H2K2 2/20 0.50
▸ TNKS O95271 1/20 0.50
▸ NTRK1 P04629 1/20 0.47
▸ MAP3K10 Q02779 1/20 0.47
▸ KIF11 P52732 2/20 0.46
▸ KDM4E B2RXH2 3/20 0.43
▸ ATM Q13315 1/20 0.43
▸ NPC1 O15118 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ XBP1 P17861 1/20 0.41
▸ AHR P35869 2/20 0.41
▸ NPSR1 Q6W5P4 3/20 0.40

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
SCHEMBL18101320 0.82 MEN1 (0.59) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL25681761 0.80 MEN1 (0.56) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL22045031 0.78 MAPT (0.49) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL17660906 0.77 MEN1 (0.55) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL30887363 0.76 MEN1 (0.69) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL22011388 0.76 MAP3K9 (0.67) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL15138782 0.76 MEN1 (0.69) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL29506382 0.76 MEN1 (0.69) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL19991631 0.76 MEN1 (0.51) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL22044984 0.76 MAPT (0.65) MAPTMEN1KMT2ARAB9ACDK4

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
EP-3266787-B1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO LTD (KR) 2022-07-06 — — EP disclosed
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