SCHEMBL6403554

SCHEMBL6403554

Cc1cccc(C(=O)NCc2cc(CCl)no2)c1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.58
HPGD P15428 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
ATM Q13315 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HTT P42858 1/20 0.44
LMNA P02545 1/20 0.44
THRB P10828 2/20 0.43
MAPT P10636 1/20 0.43
SLC5A7 Q9GZV3 1/20 0.43
RORC P51449 1/20 0.43

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
SCHEMBL6403548 0.86 KDM4E (0.53) POLBHPGDMEN1KMT2ACA1
SCHEMBL6409368 0.86 TDP1 (0.52) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL6407737 0.86 HDAC6 (0.49) POLBHPGDMEN1KMT2ANPC1
SCHEMBL6406674 0.85 HPGD (0.58) POLBHPGDMEN1KMT2ASMN1; SMN2
SCHEMBL6407596 0.81 NPC1 (0.58) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL6402219 0.80 POLB (0.55) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL6407951 0.80 HDAC4 (0.54) POLBHPGDMEN1KMT2ANPC1
SCHEMBL6404074 0.80 SMN1; SMN2 (0.51) POLBMEN1KMT2ANPC1RAB9A
SCHEMBL6404399 0.80 HSD17B10 (0.48) KMT2ASMN1; SMN2
SCHEMBL6408033 0.79 NPC1 (0.52) POLBMEN1KMT2ANPC1RAB9A

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
WO-2005107374-A2 A PROCESS FOR THE PREPARATION OF 1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLIC ACID DERIVATIVE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2005-11-17 WO disclosed
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 POLB 3713/4885HPGD 3244/4885MEN1 3154/4885

“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.