SCHEMBL6403684

SCHEMBL6403684

COC(=O)c1cccc(OCc2cc(CNC(=O)c3ccc(OC)cc3)on2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
CYSLTR1 Q9Y271 1/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
SMPD1 P17405 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
VDR P11473 1/20 0.46
POLB P06746 1/20 0.45
BLM P54132 1/20 0.45
TSHR P16473 1/20 0.45
ATM Q13315 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
USP2 O75604 1/20 0.45
MAPK1 P28482 1/20 0.45
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
NR1H4 Q96RI1 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL6405981 0.92 NPC1 (0.57) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6401570 0.91 KMT2A (0.50) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6405096 0.89 NPC1 (0.50) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6407567 0.89 KMT2A (0.55) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6403186 0.89 KMT2A (0.53) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6408051 0.88 ALDH1A1 (0.50) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6402458 0.88 RAB9A (0.47) NPC1RAB9AKMT2AMEN1SMPD1
SCHEMBL6405118 0.85 PLK1 (0.50) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6405537 0.85 NPC1 (0.54) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL6405167 0.85 RAB9A (0.50) NPC1RAB9AKMT2AMEN1SMN1; SMN2

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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide SDS BIOTECH K.K. (JP) 2005-08-04 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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide AHR, ERG28, CYP1A2 NPC1 1915/4885RAB9A 4044/4885CYSLTR1 3471/4885

“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.