SCHEMBL6440335

SCHEMBL6440335

COc1cc(C(=O)NC2CCN(C)C(C)(C)C2(C)C)ccc1-c1cc2cc(Cl)c(Cl)cc2n1C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.36
F10 P00742 1/20 0.36
TAS1R3 Q7RTX0 3/20 0.36
TAS1R1 Q7RTX1 3/20 0.36
CHRNA7 P36544 1/20 0.36
TACR2 P21452 1/20 0.35
TACR1 P25103 1/20 0.35
SCN9A Q15858 4/20 0.35
SCN5A Q14524 3/20 0.35
PHGDH O43175 1/20 0.35
ACHE P22303 1/20 0.35
MAPT P10636 1/20 0.35
LRRK2 Q5S007 1/20 0.34
IGF1R P08069 1/20 0.34

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
SCHEMBL6437533 0.81 EZH2 (0.40) USP30F10TAS1R3TAS1R1TACR2
SCHEMBL6438399 0.71 AVPR1A (0.36) PHGDH
SCHEMBL5651921 0.66 CHRM4 (0.42) USP30TACR2TACR1MAPTLRRK2
SCHEMBL6439903 0.63 MEN1 (0.41) USP30TACR2TACR1LRRK2
SCHEMBL10807044 0.61 OPRD1 (0.59) F10TAS1R3CHRNA7
Hydrochloric Acid SCHEMBL10807864 0.61 OPRD1 (0.58) F10TAS1R3CHRNA7
SCHEMBL6582988 0.60 MEN1 (0.54)
SCHEMBL5651068 0.60 PRSS12 (0.47) USP30LRRK2
SCHEMBL5789239 0.58 ACLY (0.46) PHGDH
SCHEMBL738237 0.58 HTR4 (0.53) LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042316-B1 INDOLE DERIVATIVES USEFUL A.O. FOR THE TREATMENT OF OSTEOPOROSIS NIKEM RESEARCH SRL (IT) 2005-02-09 EP claimed