SCHEMBL25980896

SCHEMBL25980896

Cc1ccc(N(Cc2ccc(C(=O)NOI)cc2)C(=O)N2CCOCC2)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.42
NPC1 O15118 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 1/20 0.42
EPHX2 P34913 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
USP2 O75604 1/20 0.41
ESR1 P03372 1/20 0.41
HPGD P15428 2/20 0.39
GLA P06280 1/20 0.39
CYP2D6 P10635 1/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
HTT P42858 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
SCHEMBL25980910 0.90 HDAC1 (0.43) RAB9ANPC1SMN1; SMN2MAPTEPHX2
SCHEMBL25980920 0.86 L3MBTL1 (0.42) RAB9ANPC1ALDH1A1HPGDMEN1
SCHEMBL22218749 0.83 GAA (0.43) RAB9ANPC1SMN1; SMN2MAPTEPHX2
SCHEMBL25981775 0.82 HPGD (0.47) RAB9ANPC1SMN1; SMN2ALDH1A1HPGD
SCHEMBL22218776 0.82 ALDH1A1 (0.42) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL25980785 0.81 HDAC1 (0.40) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL16211346 0.80 STAT3 (0.46) KDM4EALDH1A1USP2ESR1CYP2D6
SCHEMBL25980822 0.80 HDAC1 (0.46) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL22217968 0.80 ALDH1A1 (0.46) SMN1; SMN2EPHX2KDM4EALDH1A1HPGD
SCHEMBL25981781 0.78 HDAC1 (0.49) RAB9ANPC1SMN1; SMN2ALDH1A1GAA

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-20230248735-A1 COMPOSITIONS FOR PREVENTING OR TREATING CHRONIC OBSTRUCTIVE PULMONARY DISEASES (COPD) CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2023-08-10 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-20230248735-A1 COMPOSITIONS FOR PREVENTING OR TREATING CHRONIC OBSTRUCTIVE PULMONARY DISEASES (COPD) NR1H2, CFTR, CYP11B2 RAB9A 2535/4885NPC1 176/4885SMN1; SMN2 4332/4885

“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.