SCHEMBL10695952

SCHEMBL10695952

CCC(Cl)Oc1ccc(Cc2cn3cccc(C)c3n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
KDM4E B2RXH2 5/20 0.48
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPK1 P28482 2/20 0.48
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 2/20 0.45
HSD17B10 Q99714 4/20 0.42
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 2/20 0.40
HRH3 Q9Y5N1 3/20 0.39

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
SCHEMBL5411351 0.81 NPC1 (0.61) MAPTKDM4ERAB9ANPC1ALDH1A1
SCHEMBL10695954 0.79 RAB9A (0.56) MAPTKDM4ERAB9ANPC1ALDH1A1
SCHEMBL7676622 0.77 HSD17B10 (0.40) MAPTKDM4ERAB9ANPC1ALDH1A1
SCHEMBL103116 0.71 RAB9A (0.61) MAPTKDM4ERAB9ANPC1ALDH1A1
SCHEMBL9570481 0.71 RAB9A (0.61) MAPTKDM4ERAB9ANPC1ALDH1A1
SCHEMBL7675253 0.70 NPC1 (0.65) MAPTKDM4ERAB9ANPC1ALDH1A1
SCHEMBL7684449 0.70 HRH3 (0.59) MAPTKDM4ERAB9ANPC1ALDH1A1
SCHEMBL9570359 0.69 KDM4E (0.59) MAPTKDM4ERAB9ANPC1ALDH1A1
SCHEMBL9482343 0.68 LTA4H (0.53) LMNAHTT
SCHEMBL9570110 0.67 RAB9A (0.60) MAPTKDM4ERAB9ANPC1ALDH1A1

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-4791117-A LOCAL ANTESTHETICS, ANTISECRETORY AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-12-13 US disclosed