SCHEMBL25022336

SCHEMBL25022336

CCOC(=O)C(Cc1ccc(F)cc1)NC(=O)C(N)Cc1ccc(N(CCCl)CCCl)cc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.43
▸ CYP3A4 P08684 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ HIF1A Q16665 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ ABCB11 O95342 1/20 0.42
▸ CHRM2 P08172 1/20 0.42
▸ ADRA2A P08913 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ PTGS1 P23219 1/20 0.42
▸ OPRM1 P35372 1/20 0.42
▸ DRD3 P35462 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42

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
Melphalan Flufenamide SCHEMBL18239898 0.91 LMNA (0.53) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1
Melphalan Flufenamide SCHEMBL20208719 0.91 LMNA (0.53) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1
Melphalan Flufenamide SCHEMBL24101233 0.91 LMNA (0.53) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1
Melphalan Flufenamide SCHEMBL29375249 0.90 LMNA (0.52) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1
SCHEMBL10653540 0.86 LMNA (0.47) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1
SCHEMBL6838403 0.86 LMNA (0.47) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1
SCHEMBL24251989 0.85 LMNA (0.47) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1
SCHEMBL25022665 0.85 LMNA (0.40) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1
SCHEMBL25022847 0.84 LMNA (0.36) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1
SCHEMBL24100557 0.82 LMNA (0.44) LMNACYP3A4SMN1; SMN2KMT2AALDH1A1

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
EP-3866931-B1 COMPOUNDS CONTAINING DEUTERIUM ONCOPEPTIDES AB (SE) 2023-02-15 — — EP disclosed
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