SCHEMBL13106947

SCHEMBL13106947

Cc1c2cc(NCc3ccc(Cl)cc3)c(F)cc2nn1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MCHR1 Q99705 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
TRPM5 Q9NZQ8 1/20 0.40
BRD4 O60885 2/20 0.39
KAT2B Q92831 1/20 0.39
GFER P55789 1/20 0.39
HRH4 Q9H3N8 2/20 0.39
PDE2A O00408 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
BRD9 Q9H8M2 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
SCHEMBL13106985 0.86 TP53 (0.40) CHRM4NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL13106945 0.81 ADORA2A (0.42) NPC1RAB9ASMN1; SMN2MAPTMAPK1
SCHEMBL13106923 0.79 RAB9A (0.60) NPC1RAB9ASMN1; SMN2MAPTMAPK1
SCHEMBL14077552 0.79 RAB9A (0.56) CHRM4NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL13106989 0.76 TRPM5 (0.39) NPC1RAB9ASMN1; SMN2MAPTMAPK1
SCHEMBL13106928 0.76 RAB9A (0.44) CHRM4NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL13122115 0.72 HSD17B10 (0.46) MAPK1KMT2AMEN1BRD4POLB
SCHEMBL13106912 0.71 MCHR1 (0.47) CHRM4NPC1RAB9ASMN1; SMN2MCHR1
SCHEMBL13106276 0.71 CHRM4 (0.43) CHRM4MAPTMCHR1BRD9
SCHEMBL13106185 0.70 CHRM4 (0.39) CHRM4HTTMCHR1

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
US-7812045-B2 Antifungal triazole derivatives DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2010-10-12 US disclosed
US-20080194661-A1 Antifungal Triazole Derivatives DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2008-08-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080194661-A1 Antifungal Triazole Derivatives ERG28, CYP51A1, CYP3A43 CHRM4 4819/4885NPC1 47/4885RAB9A 2353/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.