SCHEMBL6403544

SCHEMBL6403544

Cc1ccc(-c2cc(CNC(=O)NC3CCCC3)on2)cc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
HPGD P15428 1/20 0.57
NPC1 O15118 3/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
POLB P06746 2/20 0.51
S1PR1 P21453 1/20 0.51
EPHX2 P34913 1/20 0.50
TSHR P16473 1/20 0.50
CYP1A2 P05177 1/20 0.49
LMNA P02545 2/20 0.48
ALDH1A1 P00352 3/20 0.47
HTT P42858 3/20 0.47
JAK2 O60674 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 2/20 0.45
EPHX1 P07099 2/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL6402421 0.99 RAB9A (0.59) RAB9ASMN1; SMN2HPGDNPC1MEN1
SCHEMBL6404226 0.87 EPHX1 (0.57) RAB9ASMN1; SMN2HPGDNPC1MEN1
SCHEMBL6407634 0.84 POLB (0.53) RAB9ASMN1; SMN2HPGDNPC1MEN1
SCHEMBL6404231 0.83 POLB (0.52) RAB9ASMN1; SMN2HPGDNPC1MEN1
SCHEMBL6403386 0.81 POLB (0.53) RAB9ASMN1; SMN2HPGDMEN1KMT2A
SCHEMBL6409949 0.81 EPHX2 (0.57) RAB9ASMN1; SMN2HPGDNPC1MEN1
SCHEMBL25833852 0.77 EPHX2 (0.53) RAB9ASMN1; SMN2HPGDKMT2APOLB
SCHEMBL6407970 0.77 POLB (0.59) RAB9ASMN1; SMN2HPGDNPC1MEN1
SCHEMBL6402395 0.77 POLB (0.53) RAB9ASMN1; SMN2HPGDNPC1MEN1
SCHEMBL6405937 0.77 NPC1 (0.56) RAB9ASMN1; SMN2HPGDNPC1MEN1

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 RAB9A 4044/4885SMN1; SMN2 4458/4885HPGD 3244/4885

“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.