SCHEMBL25980807

SCHEMBL25980807

CCc1cc(N(Cc2ccc(C(=O)NOI)cc2)C(=O)N2CC(C)OC(C)C2)ccc1C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.38
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
ALDH1A1 P00352 4/20 0.35
HPGD P15428 3/20 0.35
CYP2C19 P33261 2/20 0.35
KCNH2 Q12809 2/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 2/20 0.32
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL25980773 0.88 MERTK (0.40) ALDH1A1HPGDKCNH2KMT2ASMN1; SMN2
SCHEMBL25980785 0.86 HDAC1 (0.40) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL25980762 0.86 HDAC1 (0.39) ALDH1A1HPGDKCNH2KMT2ASMN1; SMN2
SCHEMBL25980814 0.85 ALDH1A1 (0.40) ALDH1A1KCNH2KMT2AMEN1SMN1; SMN2
SCHEMBL25980818 0.85 SMN1; SMN2 (0.38) L3MBTL1ALDH1A1HPGDKCNH2KMT2A
SCHEMBL25980920 0.82 L3MBTL1 (0.42) L3MBTL1CYP1A2CYP3A4CYP2C9ALDH1A1
SCHEMBL25981153 0.81 CCR5 (0.41) L3MBTL1CYP1A2CYP3A4CYP2C9ALDH1A1
SCHEMBL25980754 0.81 HDAC6 (0.48) ALDH1A1KMT2ASMN1; SMN2
SCHEMBL25979308 0.78 TSHR (0.41) L3MBTL1ALDH1A1HPGDKMT2AMEN1
SCHEMBL25981775 0.76 HPGD (0.47) ALDH1A1HPGDKMT2AMEN1SMN1; 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-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 L3MBTL1 4497/4885CYP1A2 432/4885CYP3A4 1676/4885

“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.