SCHEMBL17124517

SCHEMBL17124517

CCCCCCc1ccc2c(c1)C(C)(C)c1cc(N(c3ccc(Br)cc3)c3ccc(Br)cc3)ccc1-2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.39
▸ KAT8 Q9H7Z6 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ LPL P06858 5/20 0.35
▸ LIPG Q9Y5X9 5/20 0.35
▸ TRPV1 Q8NER1 1/20 0.35
▸ MGLL Q99685 1/20 0.35
▸ SKP2 Q13309 1/20 0.35
▸ ESR1 P03372 2/20 0.35
▸ ADRA2A P08913 2/20 0.35
▸ ADORA3 P0DMS8 2/20 0.35
▸ TACR2 P21452 2/20 0.35
▸ SLC6A2 P23975 2/20 0.35

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
SCHEMBL17124516 0.89 GPR3 (0.39) GPR3KAT8LMNALPLLIPG
SCHEMBL19075301 0.89 GPR3 (0.45) GPR3KAT8LPLLIPGTRPV1
SCHEMBL26226736 0.88 GPR3 (0.39) GPR3NPC1NFKB1RAB9ANFKB2
SCHEMBL11887119 0.87 SKP2 (0.41) GPR3SMN1; SMN2LPLLIPGSKP2
SCHEMBL19320306 0.87 GPR3 (0.43) GPR3KAT8LMNANPC1GAA
SCHEMBL15071816 0.87 GPR3 (0.43) GPR3KAT8LMNANPC1GAA
SCHEMBL20100713 0.82 PDK2 (0.31) —
SCHEMBL15861384 0.81 NPC1 (0.48) GPR3NPC1GAANFKB1RAB9A
SCHEMBL11887136 0.81 PDK2 (0.43) LPLLIPGESR1
SCHEMBL16416645 0.80 MAOA (0.33) GAARAB9AKDM4EALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3674343-A1 POLYMER COMPOUND AND LIGHT-EMITTING ELEMENT USING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-07-01 — — EP disclosed
US-9963550-B2 Polymers and organic electronic device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2018-05-08 — — US disclosed
US-20170253795-A1 POLYMER COMPOUND AND LIGHT-EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-09-07 — — US disclosed
EP-3187522-A1 POLYMER COMPOUND AND LIGHT-EMITTING ELEMENT USING SAME Sumitomo Chemical Company Limited (JP) 2017-07-05 — — EP disclosed
US-20150274890-A1 POLYMERS AND ORGANIC ELECTRONIC DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2015-10-01 — — US disclosed
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