SCHEMBL38658948

SCHEMBL38658948

CCOC(=O)/C(=C/c1cc(I)cc(OCc2ccccc2)c1OC)N=[N+]=[N-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 1/20 0.39
▸ LMNA P02545 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ PLIN1 O60240 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ PLIN5 Q00G26 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ABHD5 Q8WTS1 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ APP P05067 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ PDE4A P27815 1/20 0.34

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
SCHEMBL31295218 0.79 NR1H4 (0.42) NR1H4LMNAMAPTMEN1PLIN1
SCHEMBL38659096 0.76 KDM4E (0.32) LMNAMAPTPOLBHPGDSMN1; SMN2
SCHEMBL38660353 0.74 ALDH1A1 (0.47) LMNAMAPTMEN1PLIN1POLB
SCHEMBL27537188 0.74 NR1H4 (0.67) NR1H4LMNAMAPTMEN1KMT2A
SCHEMBL27252480 0.74 CCNB2 (0.47) LMNAMAPTMEN1KMT2AHPGD
SCHEMBL16303657 0.74 CCNB2 (0.47) LMNAMAPTMEN1KMT2AHPGD
SCHEMBL14608164 0.73 MEN1 (0.46) LMNAMAPTMEN1PLIN1POLB
SCHEMBL38659438 0.73 ERN1 (0.49) LMNAMAPTNPC1HPGDRAB9A
SCHEMBL25240005 0.71 MEN1 (0.41) LMNAMAPTMEN1PLIN1POLB
SCHEMBL14653903 0.71 MAPT (0.41) LMNAMAPTMEN1PLIN1POLB

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
WO-2026102212-A1 MACROCYCLIC MCL-1 INHIBITORS VANDERBILT UNIVERSITY (US) 2026-05-15 — — WO disclosed
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