SCHEMBL5772547

SCHEMBL5772547

CC1CC(c2ncc3nccc-3[nH]2)CC(c2ccc(Cl)cc2)N1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
KDM1A O60341 1/20 0.32
MAOB P27338 1/20 0.32

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
Hydrochloric Acid SCHEMBL5772584 0.99 MAPT (0.32) MAPTMAPK1KDM1AMAOB
SCHEMBL5771685 0.90 MEN1 (0.33) MAPTKDM1A
SCHEMBL5774723 0.89 ALDH1A1 (0.32) MAPT
SCHEMBL5771433 0.88 NPY5R (0.32) MAPT
Hydrochloric Acid SCHEMBL5772599 0.88 ALDH1A1 (0.32) MAPT
Hydrochloric Acid SCHEMBL5775499 0.87 HPGDS (0.32)
SCHEMBL5771660 0.87 SLC9A1 (0.32) KDM1AMAOB
SCHEMBL5773252 0.87 HPGDS (0.34)
Hydrochloric Acid SCHEMBL5775416 0.86 NPY5R (0.31)
SCHEMBL5773116 0.86

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054887-B1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC (US) 2006-04-12 EP claimed
US-6187777-B1 PYRROLO(3,2-D)PYRIMIDINE DERIVATIVES; NEUROPEPTIDE Y AND CORTICOTROPIN RELEASING FACTOR MODULATORS; DIETETICS; ANTIDIABETIC, ANTIINFLAMMATORY, AND ANTITUMOR AGENTS AMGEN INC. 2001-02-13 US claimed