SCHEMBL18174883

SCHEMBL18174883

CCCC[C@H](C)c1cccc2sc3ccccc3c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.37
▸ CNR2 P34972 5/20 0.36
▸ CNR1 P21554 4/20 0.36
▸ PTPN1 P18031 2/20 0.35
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ FAAH O00519 1/20 0.32
▸ MGLL Q99685 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ DUSP3 P51452 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ PTPN5 P54829 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ CTDSP1 Q9GZU7 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ LMNA P02545 1/20 0.32

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
SCHEMBL30173368 0.89 MAPT (0.42) CNR2CNR1MEN1KMT2AMAPT
SCHEMBL2384224 0.84 TSHR (0.46) GPR3CNR2CNR1MEN1KMT2A
SCHEMBL23775993 0.84 TSHR (0.46) GPR3CNR2CNR1MEN1KMT2A
SCHEMBL2673792 0.84 MAPT (0.40) CNR2CNR1MEN1KMT2AMAPT
SCHEMBL1102417 0.77 GPR3 (0.48) GPR3MEN1KMT2AMAPTFAAH
SCHEMBL2386903 0.76 GPR3 (0.39) GPR3CNR2CNR1MEN1KMT2A
SCHEMBL6685019 0.75 TSHR (0.45) CNR2MEN1KMT2AMAPTPOLB
SCHEMBL18174894 0.75 NQO1 (0.38) PTPN1LMNARAB9ANPC1CYP1A2
SCHEMBL19802946 0.74 GPR3 (0.45) GPR3CNR2CNR1MEN1KMT2A
SCHEMBL28230514 0.74 GPR3 (0.45) GPR3MEN1KMT2AMAPTPOLB

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-9478758-B1 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2016-10-25 — — US disclosed
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