SCHEMBL30708647

SCHEMBL30708647

COCCOCCN(C)Cc1ccc(N/C(=C2\C(=O)Nc3cc(C(=O)OC)ccc32)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.41
MCHR1 Q99705 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
LTA4H P09960 1/20 0.37

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
SCHEMBL2570287 1.00 ACHE (0.41) ACHEMCHR1KDM4EALDH1A1MEN1
SCHEMBL2570281 1.00 ACHE (0.41) ACHEMCHR1KDM4EALDH1A1MEN1
SCHEMBL2571485 0.95 MCHR1 (0.41) ACHEMCHR1KDM4EALDH1A1MEN1
SCHEMBL2571487 0.95 MCHR1 (0.41) ACHEMCHR1KDM4EALDH1A1MEN1
SCHEMBL3714775 0.95 MCHR1 (0.41) ACHEMCHR1KDM4EALDH1A1MEN1
SCHEMBL2571272 0.94 RXFP1 (0.42) ACHEMCHR1MEN1KMT2ASMN1; SMN2
SCHEMBL2571276 0.94 RXFP1 (0.42) ACHEMCHR1MEN1KMT2ASMN1; SMN2
SCHEMBL4488651 0.90 ACHE (0.45) ACHEMCHR1MEN1KMT2ASMN1; SMN2
SCHEMBL4493352 0.90 ACHE (0.38) ACHEMCHR1KDM4ELTA4H
SCHEMBL4488657 0.90 ACHE (0.45) ACHEMCHR1MEN1KMT2ASMN1; 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-20230372297-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES BOEHRINGER INGELHEIM INT (DE) 2023-11-23 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-20230372297-A1 MEDICAMENTS FOR THE TREATMENT OR PREVENTION OF FIBROTIC DISEASES MMP1, COL1A1, SMAD3 ACHE 2390/4885MCHR1 2430/4885KDM4E 3638/4885

“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.