SCHEMBL21282039

SCHEMBL21282039

Fc1cc2c3ccccc3sc2c2[nH]c3ccccc3c12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.59
▸ KMT2A Q03164 4/20 0.59
▸ MAPT P10636 4/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ TNKS O95271 2/20 0.54
▸ TNKS2 Q9H2K2 2/20 0.54
▸ MAP3K9 P80192 3/20 0.52
▸ MAP3K11 Q16584 3/20 0.52
▸ CDK4 P11802 3/20 0.52
▸ CCND1 P24385 3/20 0.52
▸ NTRK1 P04629 1/20 0.47
▸ MAP3K10 Q02779 1/20 0.47
▸ HTT P42858 2/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ PPARG P37231 1/20 0.43
▸ NCOA2 Q15596 1/20 0.43
▸ NCOA1 Q15788 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43

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
SCHEMBL20175697 0.82 MEN1 (0.59) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL25996710 0.80 MEN1 (0.56) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL29506382 0.80 MEN1 (0.69) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL15138782 0.80 MEN1 (0.69) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL30887363 0.80 MEN1 (0.69) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL25201976 0.77 MEN1 (0.55) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL22011388 0.76 MAP3K9 (0.67) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL30388681 0.76 CDK4 (0.46) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL25195003 0.76 CDK4 (0.46) MEN1KMT2AMAPTRAB9ATNKS
SCHEMBL8654364 0.76 MEN1 (1.00) MEN1KMT2AMAPTRAB9ATNKS

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
WO-2019172623-A1 COMPOUND FOR ORGANIC ELECTRIC DEVICE, ORGANIC ELECTRIC DEVICE USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2019-09-12 — — WO disclosed
WO-2019160335-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2019-08-22 — — WO disclosed
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