SCHEMBL6948875

SCHEMBL6948875

CCCC(C)n1nc(C(=O)Cl)c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR4 Q13639 12/20 0.44
▸ KMT2A Q03164 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ELANE P08246 3/20 0.40
▸ F2 P00734 1/20 0.40
▸ PLAU P00749 1/20 0.40
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38

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
SCHEMBL6956835 0.89 HTR4 (0.43) HTR4KMT2AKDM4EELANEF2
SCHEMBL6950067 0.89 HTR4 (0.43) HTR4KMT2AKDM4EELANEF2
SCHEMBL6956828 0.89 HTR4 (0.43) HTR4KMT2AKDM4EELANEF2
SCHEMBL6956445 0.88 HTR4 (0.45) HTR4KMT2AKDM4EELANEF2
SCHEMBL8874909 0.86 ELANE (0.48) HTR4KMT2AKDM4EELANEF2
SCHEMBL1405874 0.83 HTR4 (0.55) HTR4KMT2AKDM4E
SCHEMBL6956782 0.82 HTR4 (0.41) HTR4KMT2AKDM4EELANEF2
SCHEMBL6956165 0.77 HTR4 (0.42) HTR4KMT2AKDM4EELANEF2
SCHEMBL6956554 0.76 KMT2A (0.46) HTR4KMT2AKDM4EELANEF2
SCHEMBL6956548 0.76 KMT2A (0.46) HTR4KMT2AKDM4EELANEF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0829474-B1 INDAZOLE DERIVATIVES HAVING MONOCYCLIC AMINO GROUP NISSHIN SEIFUN GROUP INC (JP) 2003-04-09 — — EP disclosed
US-6096746-A Indazole compound containing a monocyclic amine structure NISSHIN FLOUR MILLING CO., LTD. (JP) 2000-08-01 — — US disclosed
US-5945434-A TREATMENT OF GASTROINTESTINAL DISORDERS NISSHIN FLOUR MILLING CO., LTD. (JP) 1999-08-31 — — US disclosed
EP-0708105-B1 5-HT4 receptor agonists NISSHIN FLOUR MILLING CO (JP) 1998-12-23 — — EP disclosed
EP-0829474-A1 INDAZOLE DERIVATIVES HAVING MONOCYCLIC AMINO GROUP NISSHIN FLOUR MILLING CO., LTD. (JP) 1998-03-18 — — EP disclosed
US-5684003-A GASTROINTESTINAL DISORDERS OR ANTIULCER AGENTS NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-11-04 — — US disclosed
EP-0708105-A1 5-HT4 receptor agonists NISSHIN FLOUR MILLING CO., LTD. (JP) 1996-04-24 — — EP disclosed
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