SCHEMBL17430704

SCHEMBL17430704

Cc1ccc(N(c2ccccc2)c2ccc3c(c2)C(c2ccc4c(c2)CC4)(c2ccc4c(c2)CC4)c2cc(N(c4ccccc4)c4cccc(C)c4)ccc2-3)cc1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ PKM P14618 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ ESR2 Q92731 1/20 0.32
▸ ICMT O60725 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ PDK2 Q15119 1/20 0.30

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
SCHEMBL16682939 0.95 ESR1 (0.34) RAB9AALDH1A1MAPTSMN1; SMN2ESR1
SCHEMBL13174532 0.90 NPC1 (0.33) RAB9AALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL18472735 0.89 NPC1 (0.33) RAB9AALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL19497131 0.89 KDM4E (0.33) RAB9AALDH1A1KDM4EGAAMAPT
SCHEMBL17430705 0.88 — —
SCHEMBL20404422 0.86 KDM4E (0.32) ALDH1A1KDM4EMAPTSMN1; SMN2ESR1
SCHEMBL13174545 0.84 NPC1 (0.30) RAB9AALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL14518387 0.84 ICMT (0.36) RAB9AALDH1A1PKMKDM4EMAPT
SCHEMBL31324815 0.84 ICMT (0.36) RAB9AALDH1A1PKMKDM4EMAPT
SCHEMBL30487699 0.84 ICMT (0.36) RAB9AALDH1A1PKMKDM4EMAPT

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-20160013418-A1 POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-01-14 — — US disclosed
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