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SCHEMBL6287891

SCHEMBL6287891

O=C(Cc1c[nH]c2ccccc12)NCCC(=O)Nc1ccc(C(c2ccc(NC(=O)CCNC(=O)Cc3c[nH]c4ccccc34)cc2)c2ccc(NC(=O)CCNC(=O)Cc3c[nH]c4ccccc34)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.54
▸ HRH3 Q9Y5N1 4/20 0.53
▸ ALDH1A1 P00352 3/20 0.53
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ HDAC1 Q13547 3/20 0.52
▸ GOT1 P17174 2/20 0.51

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
SCHEMBL6287876 0.89 HRH3 (0.55) MAPTHRH3ALDH1A1KMT2ALMNA
SCHEMBL7976825 0.80 SMN1; SMN2 (0.71) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL18229441 0.80 HRH3 (0.65) MAPTHRH3ALDH1A1MEN1KMT2A
SCHEMBL6287895 0.79 HRH3 (0.53) MAPTHRH3ALDH1A1MEN1KMT2A
SCHEMBL6287783 0.78 HDAC8 (0.61) MAPTLMNAHDAC1
SCHEMBL6287685 0.78 HDAC1 (0.52) MAPTHRH3ALDH1A1HDAC1
SCHEMBL6286756 0.78 KDM4E (0.49) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL31218207 0.78 HRH3 (0.67) MAPTHRH3ALDH1A1MEN1KMT2A
SCHEMBL7807900 0.78 HRH3 (0.67) MAPTHRH3ALDH1A1MEN1KMT2A
SCHEMBL27333111 0.77 HRH3 (0.67) MAPTHRH3ALDH1A1MEN1KMT2A

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
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 — — US disclosed