SCHEMBL28037982

SCHEMBL28037982

Cc1ccc2cccc(-c3ccccc3-c3ccc(O)cc3)c2n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 1/20 0.53
▸ ABL1 P00519 2/20 0.43
▸ ABCB1 P08183 2/20 0.43
▸ BCR P11274 2/20 0.43
▸ PARP1 P09874 1/20 0.43
▸ TGFBR1 P36897 1/20 0.43
▸ MAPK14 Q16539 1/20 0.43
▸ CCR1 P32246 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ CCR5 P51681 1/20 0.42
▸ MAPT P10636 4/20 0.40
▸ GAA P10253 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TTR P02766 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40

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
SCHEMBL28767599 0.98 METAP2 (0.51) METAP2ABL1ABCB1BCRPARP1
SCHEMBL27729410 0.84 ESR2 (0.46) METAP2PARP1CCR1RAB9ACCR5
SCHEMBL2115749 0.81 CCR1 (0.64) METAP2PARP1CCR1RAB9ACCR5
SCHEMBL27594921 0.80 METAP2 (0.53) METAP2PARP1TGFBR1CCR1RAB9A
8-Hydroxy Quinaldine SCHEMBL195825 0.78 METAP2 (0.72) METAP2PARP1CCR1RAB9ACCR5
8-Hydroxy Quinaldine SCHEMBL27650187 0.78 METAP2 (0.72) METAP2PARP1CCR1RAB9ACCR5
8-Hydroxy Quinaldine SCHEMBL132450 0.77 METAP2 (0.70) METAP2PARP1CCR1RAB9ACCR5
8-Hydroxy Quinaldine SCHEMBL461474 0.77 METAP2 (0.70) METAP2PARP1CCR1RAB9ACCR5
8-Hydroxy Quinaldine SCHEMBL5142152 0.77 METAP2 (0.70) METAP2PARP1CCR1RAB9ACCR5
8-Hydroxy Quinaldine SCHEMBL21141877 0.77 METAP2 (0.70) METAP2PARP1CCR1RAB9ACCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105492424-A Indenoindole derivative and organic electroluminescent element HODOGAYA CHEMICAL CO LTD 2016-04-13 — — CN disclosed
CN-105452255-A Dicarbazole derivative and organic electroluminescent element HODOGAYA CHEMICAL CO LTD 2016-03-30 — — CN disclosed
CN-105143198-A Novel naphthotriazole derivative and organic electroluminescence element HODOGAYA CHEMICAL CO LTD 2015-12-09 — — CN disclosed
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