Fluoride

Fluoride

SCHEMBL28073285

F.c1cnc(N2CCCCC2)nc1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.56
ALDH1A1 P00352 5/20 0.56
USP2 O75604 1/20 0.55
POLB P06746 1/20 0.55
LMNA P02545 3/20 0.54
MAPT P10636 2/20 0.54
TSHR P16473 3/20 0.47
KMT2A Q03164 3/20 0.47
HTT P42858 2/20 0.47
MEN1 O00255 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C19 P33261 2/20 0.47
GAA P10253 1/20 0.47
CYP3A4 P08684 1/20 0.47
HSD17B10 Q99714 2/20 0.46
CYP1A2 P05177 2/20 0.46
TDP1 Q9NUW8 1/20 0.45
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.43

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
SCHEMBL1928132 0.97 KDM4E (0.58) KDM4EALDH1A1USP2POLBLMNA
SCHEMBL139049 0.97 KDM4E (0.58) KDM4EALDH1A1USP2POLBLMNA
SCHEMBL2951425 0.97 KDM4E (0.58) KDM4EALDH1A1USP2POLBLMNA
SCHEMBL3339822 0.95 KDM4E (0.60) KDM4EALDH1A1USP2POLBLMNA
SCHEMBL18228600 0.95 KDM4E (0.60) KDM4EALDH1A1USP2POLBLMNA
Fluoride SCHEMBL28112400 0.90 KDM4E (0.56) KDM4EALDH1A1USP2POLBLMNA
SCHEMBL2168776 0.90 KDM4E (0.60) KDM4EALDH1A1USP2POLBLMNA
Piperazine SCHEMBL28080084 0.89 ALDH1A1 (0.68) KDM4EALDH1A1USP2POLBLMNA
SCHEMBL14503198 0.89 MEN1 (0.56) KDM4EALDH1A1USP2POLBLMNA
Ammonia Solution, Strong SCHEMBL28080150 0.87 KDM4E (0.58) KDM4EALDH1A1USP2POLBLMNA

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105814043-B Triazolopyridine derivatives as TNF active regulator UCB生物制药私人有限公司 2019-05-17 CN disclosed
CN-105814049-B Fused tricyclic imdazole derivatives as TNF active regulator UCB生物制药私人有限公司 2019-03-12 CN disclosed
CN-105814041-B Benzotriazole derivatives as TNF active regulator UCB生物制药私人有限公司 2018-12-18 CN disclosed
CN-105814065-B Imidazothiazole derivative as TNF active regulator UCB生物制药私人有限公司 2018-11-23 CN disclosed
CN-105814058-B Triazolo-pyridazine derivatives as TNF active regulator UCB生物制药私人有限公司 2018-11-23 CN disclosed
CN-105814022-B Condensed bicyclic heteroaromatic derivative as TNF active regulators UCB生物制药私人有限公司 2018-09-28 CN disclosed
CN-105814054-B Condensed imidazole and pyrazole derivatives as TNF active regulators UCB生物制药私人有限公司 2018-09-25 CN disclosed
CN-105814051-B Tetrahydroimidazopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2018-09-25 CN disclosed
CN-105814025-B Tetrahydrobenzimidazderivative derivative as TNF active regulators UCB生物制药私人有限公司 2018-09-04 CN disclosed
CN-105814050-B Pyrazolopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2018-05-08 CN disclosed
CN-105814065-A Imidazothiazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814050-A Pyrazolopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814025-A Tetrahydrobenzimidazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814051-A Tetrahydroimidazopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814049-A Fused tricyclic imidazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814054-A Fused imidazole and pyrazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814041-A Benzotriazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814048-A Fused tricyclic imidazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814043-A Triazolopyridine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed
CN-105814058-A Triazolopyridazine derivatives as modulators of TNF activity UCB生物制药私人有限公司 2016-07-27 CN disclosed