SCHEMBL8421898

SCHEMBL8421898

COC(=O)CN(C(=O)CN)c1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2A1 Q16548 1/20 0.44
▸ ALDH1A1 P00352 6/20 0.43
▸ HTT P42858 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MAPT P10636 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ AOC3 Q16853 1/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ HTR3E A5X5Y0 1/20 0.39
▸ HTR3B O95264 1/20 0.39
▸ HTR3A P46098 1/20 0.39
▸ HTR3D Q70Z44 1/20 0.39
▸ HTR3C Q8WXA8 1/20 0.39
▸ CYP1A2 P05177 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
SCHEMBL9134461 0.87 ALDH1A1 (0.41) BCL2A1ALDH1A1HTTRAB9ASMN1; SMN2
SCHEMBL11159138 0.85 L3MBTL1 (0.47) BCL2A1ALDH1A1HTTRAB9ASMN1; SMN2
SCHEMBL9133587 0.83 ALDH1A1 (0.47) BCL2A1ALDH1A1HTTRAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL5967266 0.81 MLYCD (0.48) ALDH1A1SMN1; SMN2GAAKMT2AMEN1
SCHEMBL8426236 0.81 KDM4E (0.41) BCL2A1ALDH1A1HTTRAB9ASMN1; SMN2
SCHEMBL29173926 0.79 ALDH1A1 (0.45) BCL2A1ALDH1A1RAB9ASMN1; SMN2MAPT
SCHEMBL9152678 0.77 HTR3E (0.48) ALDH1A1HTTRAB9ASMN1; SMN2AOC3
Hydrochloric Acid SCHEMBL8378174 0.77 MAPT (0.48) BCL2A1ALDH1A1HTTRAB9ASMN1; SMN2
SCHEMBL7496040 0.75 HTR3E (0.58) ALDH1A1HTTRAB9ASMN1; SMN2MAPT
SCHEMBL13603840 0.75 MAPT (0.44) BCL2A1ALDH1A1RAB9AMAPTNPC1

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
US-5919785-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-07-06 — — US disclosed
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