SCHEMBL6780792

SCHEMBL6780792

COC(=O)C(N)Cc1c[nH]c2cnccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 2/20 0.47
MAPT P10636 2/20 0.47
TSHR P16473 2/20 0.47
BLM P54132 2/20 0.47
PMP22 Q01453 2/20 0.47
MPO P05164 1/20 0.47
HIF1A Q16665 1/20 0.47
AKT1 P31749 4/20 0.45
CDC7 O00311 1/20 0.45
CHUK O15111 1/20 0.45
MAPK13 O15264 1/20 0.45
DAPK3 O43293 1/20 0.45
DYRK3 O43781 1/20 0.45
ROCK2 O75116 1/20 0.45
RPS6KA5 O75582 1/20 0.45
PRKCG P05129 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
SCHEMBL7016302 0.84 KMT2A (0.66) KMT2AMEN1KDM4ELMNAMAPT
SCHEMBL1897795 0.84 KMT2A (0.66) KMT2AMEN1KDM4ELMNAMAPT
SCHEMBL31370083 0.84 KMT2A (0.66) KMT2AMEN1KDM4ELMNAMAPT
Hydrochloric Acid SCHEMBL31407554 0.82 TACR1 (0.43) TACR1KMT2AMEN1KDM4ELMNA
Tryptophan Methyl Ester SCHEMBL19161138 0.82 MEN1 (0.70) TACR1KMT2AMEN1KDM4ELMNA
Tryptophan Methyl Ester SCHEMBL1195735 0.82 MEN1 (0.70) TACR1KMT2AMEN1KDM4ELMNA
Tryptophan Methyl Ester SCHEMBL30180690 0.82 MEN1 (0.70) TACR1KMT2AMEN1KDM4ELMNA
Tryptophan Methyl Ester SCHEMBL475267 0.82 MEN1 (0.70) TACR1KMT2AMEN1KDM4ELMNA
Tryptophan Methyl Ester SCHEMBL122907 0.82 MEN1 (0.70) TACR1KMT2AMEN1KDM4ELMNA
Tryptophan Methyl Ester SCHEMBL378072 0.81 MEN1 (0.68) TACR1KMT2AMEN1KDM4ELMNA

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-6716852-B2 FOR THERAPY OF ARTERIAL HYPERTENSION AND CARDIOVASCULAR DISEASES LES LABORATORIES SERVIER (FR) 2004-04-06 US disclosed
US-20030055086-A1 Amino acid derivatives and use thereof as nep, ace and ece inhibitors LES LABORATOIRES SERVIER (FR) 2003-03-20 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-20030055086-A1 Amino acid derivatives and use thereof as nep, ace and ece inhibitors MME, ACE, ECE1 TACR1 1034/4885KMT2A 1603/4885MEN1 3195/4885

“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.