SCHEMBL1022300

SCHEMBL1022300

CCCCn1c(C)nc2ccccc21

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 4/20 0.69
▸ HTT P42858 3/20 0.66
▸ LMNA P02545 3/20 0.66
▸ TP53 P04637 2/20 0.66
▸ PKM P14618 1/20 0.63
▸ SMN1; SMN2 Q16637 2/20 0.61
▸ TSHR P16473 2/20 0.60
▸ GAA P10253 1/20 0.60
▸ TNF P01375 1/20 0.58
▸ TLR7 Q9NYK1 1/20 0.57

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
SCHEMBL20242949 0.93 TLR8 (0.70) TLR8HTTLMNATP53PKM
SCHEMBL2943250 0.93 TLR8 (0.70) TLR8HTTLMNATP53PKM
SCHEMBL31066875 0.93 TLR8 (0.70) TLR8HTTLMNATP53PKM
SCHEMBL17053182 0.93 TLR8 (0.70) TLR8HTTLMNATP53PKM
SCHEMBL9274775 0.93 TLR8 (0.70) TLR8HTTLMNATP53PKM
SCHEMBL31066882 0.93 TLR8 (0.70) TLR8HTTLMNATP53PKM
Hydrochloric Acid SCHEMBL8158771 0.92 TLR8 (0.68) TLR8HTTLMNATP53PKM
SCHEMBL2330274 0.89 LMNA (0.69) TLR8HTTLMNATP53PKM
SCHEMBL229041 0.89 POLB (0.67) HTTLMNATP53PKMSMN1; SMN2
SCHEMBL10005374 0.88 TLR8 (0.71) TLR8HTTLMNATP53SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020123670-A1 SMALL MOLECULE INHIBITORS OF THE ANDROGEN RECEPTOR ACTIVITY AND/OR EXPRESSION AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2020-06-18 — — WO disclosed
EP-2585462-B1 FUSED HETEROCYCLIC COMPOUNDS AS PHOSPHODIESTERASES (PDES) INHIBITORS TAKEDA PHARMACEUTICALS CO (JP) 2020-02-26 — — EP disclosed
US-20160172119-A9 DYE-SENSITIZED PHOTOELECTRIC CONVERSION ELEMENT GAKKO HOUJIN TOIN GAKUEN (JP) 2016-06-16 — — US disclosed
US-20150129035-A1 DYE-SENSITIZED PHOTOELECTRIC CONVERSION ELEMENT GAKKO HOUJIN TOIN GAKUEN (JP) 2015-05-14 — — US disclosed
US-8461180-B2 Inhibitors of human immunodeficiency virus replication GILEAD SCIENCES, INC. (US) 2013-06-11 — — US disclosed
US-20110041915-A1 DYE-SENSITIZED PHOTOELECTRIC CONVERSION ELEMENT PECCELL TECHNOLOGIES, INC. (JP) 2011-02-24 — — US disclosed
EP-2276103-A1 DYE-SENSITIZED PHOTOELECTRIC CONVERSION ELEMENT Peccell Technologies Inc (JP) 2011-01-19 — — EP disclosed
WO-2009062308-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-05-22 — — WO disclosed
EP-0267136-B1 QUATERNARY AMMONIUM SALTS USED AS PHASE TRANSFER CATALYSTS ALTER, S.A. (ES) 1990-09-19 — — EP disclosed
US-4880894-A Quaternary ammonium salts used as phase transfer catalyst ALTER, S.A. (ES) 1989-11-14 — — US disclosed
EP-0267136-A2 Quaternary ammonium salts used as phase transfer catalysts ALTER, S.A. (ES) 1988-05-11 — — EP disclosed
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