SCHEMBL7136755

SCHEMBL7136755

CC(CCNC(=O)CC(c1ccccc1)c1ccccc1)CC(=O)NCC(=O)C(O)CCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
TAAR1 Q96RJ0 1/20 0.47
HPGD P15428 3/20 0.46
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45
CNR1 P21554 1/20 0.45
PKM P14618 1/20 0.44
POLB P06746 1/20 0.44
TACR1 P25103 4/20 0.43
BCHE P06276 2/20 0.43
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
EPHX2 P34913 1/20 0.39

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
SCHEMBL7137518 0.90 CNR1 (0.49) LMNATAAR1HPGDALDH1A1KMT2A
SCHEMBL7139406 0.90 LMNA (0.51) LMNAHPGDALDH1A1KMT2APKM
SCHEMBL7131854 0.89 KMT2A (0.44) LMNAHPGDALDH1A1KMT2APKM
SCHEMBL7136761 0.86 EPHX1 (0.50) LMNAHPGDALDH1A1KMT2APKM
SCHEMBL7137508 0.85 LMNA (0.44) LMNAHPGDALDH1A1KMT2APKM
SCHEMBL7133782 0.85 PTPN1 (0.49) LMNATAAR1HPGDALDH1A1KMT2A
SCHEMBL7136924 0.85 HPGD (0.46) LMNATAAR1HPGDALDH1A1KMT2A
SCHEMBL7135503 0.84 ALDH1A1 (0.46) LMNAHPGDALDH1A1KMT2ACNR1
SCHEMBL7130614 0.84 LMNA (0.45) LMNAHTTSMN1; SMN2
SCHEMBL7136859 0.83 EPHX2 (0.56) LMNAHPGDALDH1A1KMT2ACNR1

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
US-20030092634-A1 Novel compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. 2003-05-15 US disclosed
US-6506733-B1 Which process comprises hydrogenating a compound of Formula 9: presence of a catalytic amount of 20% palladium hydroxide on carbon. AXYS PHARMACEUTICALS, INC. 2003-01-14 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-20030092634-A1 Novel compounds and compositions as protease inhibitors SERPINB1, HPN, CTRL LMNA 2624/4885TAAR1 4810/4885HPGD 483/4885

“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.