SCHEMBL18346740

SCHEMBL18346740

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4sc5c6[nH]c7ccccc7c6c6ccccc6c5c4c3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ MAP3K9 P80192 3/20 0.44
▸ MAP3K11 Q16584 3/20 0.44
▸ CDK4 P11802 1/20 0.44
▸ CCND1 P24385 1/20 0.44
▸ CYP1A2 P05177 2/20 0.42
▸ PPARG P37231 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ NCOA2 Q15596 1/20 0.42
▸ NCOA1 Q15788 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ NCOA3 Q9Y6Q9 1/20 0.42
▸ TNKS O95271 2/20 0.42
▸ TNKS2 Q9H2K2 2/20 0.42
▸ NTRK1 P04629 1/20 0.41

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
SCHEMBL22708729 0.89 MEN1 (0.51) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL14951582 0.84 MEN1 (0.51) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL14951565 0.84 MEN1 (0.51) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL15139068 0.84 MEN1 (0.48) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL14951578 0.80 MEN1 (0.47) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL18132843 0.79 MEN1 (0.51) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL19917037 0.79 LIMK1 (0.41) MAPTMEN1KMT2ATNKSTNKS2
SCHEMBL19917072 0.79 LIMK1 (0.41) MAPTMEN1KMT2ATNKSTNKS2
SCHEMBL15003805 0.79 MEN1 (0.48) MAPTMEN1KMT2ARAB9AMAP3K9
SCHEMBL22133226 0.79 MAP3K9 (0.49) MAPTMEN1KMT2ARAB9AMAP3K9

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
US-9530971-B1 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2016-12-27 — — US disclosed
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