SCHEMBL4270769

SCHEMBL4270769

C[C@@H](C(=O)O)N(Cc1ccccc1)c1ccc(F)c(Cl)c1.[LiH]

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
UBE2M P61081 2/20 0.42
DCUN1D1 Q96GG9 2/20 0.42
PGR P06401 1/20 0.41
ALDH1A1 P00352 1/20 0.40
S1PR1 P21453 1/20 0.39
PTGIR P43119 1/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
TSHR P16473 2/20 0.38
POLB P06746 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 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
SCHEMBL4270761 1.00 UBE2M (0.42) UBE2MDCUN1D1PGRALDH1A1S1PR1
SCHEMBL4268261 0.99 UBE2M (0.43) UBE2MDCUN1D1PGRALDH1A1S1PR1
SCHEMBL4268265 0.99 UBE2M (0.43) UBE2MDCUN1D1PGRALDH1A1S1PR1
SCHEMBL13657696 0.89 UBE2M (0.41) UBE2MDCUN1D1PGRALDH1A1S1PR1
Lithium Ion SCHEMBL4270763 0.88 UBE2M (0.41) UBE2MDCUN1D1PGRALDH1A1S1PR1
SCHEMBL4272537 0.87 UBE2M (0.42) UBE2MDCUN1D1PGRALDH1A1S1PR1
SCHEMBL4272601 0.87 UBE2M (0.42) UBE2MDCUN1D1PGRALDH1A1S1PR1
SCHEMBL4276761 0.87 MEN1 (0.49) ALDH1A1S1PR1KDM4EMEN1KMT2A
SCHEMBL4276753 0.87 MEN1 (0.49) ALDH1A1S1PR1KDM4EMEN1KMT2A
SCHEMBL4268251 0.85 MEN1 (0.50) ALDH1A1S1PR1KDM4EMEN1KMT2A

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-7608739-B2 Mitotic kinesin inhibitors MERCK & CO. INC. (US) 2009-10-27 US disclosed
US-20080234281-A1 Mitotic Kinesin Inhibitors MERCK SHARP & DOHME CORP. 2008-09-25 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-20080234281-A1 Mitotic Kinesin Inhibitors KIF5B, KIF2C, KIF18B UBE2M 2628/4885DCUN1D1 1388/4885PGR 3979/4885

“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.