SCHEMBL14626862

SCHEMBL14626862

CC(=O)Cc1ccc(/C=C/c2cn(C)c3ccccc23)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ CASP3 P42574 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ SENP8 Q96LD8 1/20 0.49
▸ SENP7 Q9BQF6 1/20 0.49
▸ SENP6 Q9GZR1 1/20 0.49
▸ ALDH1A1 P00352 4/20 0.46
▸ IMPDH2 P12268 1/20 0.46
▸ ATM Q13315 1/20 0.42
▸ HPGD P15428 3/20 0.42
▸ LMNA P02545 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ POLB P06746 2/20 0.41
▸ TSHR P16473 1/20 0.40
▸ GAA P10253 1/20 0.40

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
SCHEMBL14591788 0.87 MAPT (0.46) MAPTMEN1KMT2ANPC1CASP3
SCHEMBL14626864 0.85 MAPT (0.53) MAPTMEN1KMT2ANPC1CASP3
SCHEMBL14626639 0.84 KMT2A (0.52) MAPTMEN1KMT2ANPC1CASP3
SCHEMBL14626967 0.79 MAPT (0.73) MAPTMEN1KMT2ANPC1CASP3
SCHEMBL14626709 0.76 IMPDH2 (0.43) MAPTMEN1KMT2AALDH1A1IMPDH2
SCHEMBL14626964 0.76 MAPT (0.47) MAPTMEN1KMT2ANPC1CASP3
SCHEMBL14591793 0.73 MAPT (0.48) MAPTMEN1KMT2ANPC1CASP3
SCHEMBL8494188 0.73 KMT2A (0.73) MAPTMEN1KMT2ANPC1CASP3
SCHEMBL8494191 0.73 KMT2A (0.73) MAPTMEN1KMT2ANPC1CASP3
SCHEMBL14626638 0.73 ALDH1A1 (0.39) MAPTMEN1KMT2ANPC1CASP3

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-7157487-B2 Vla-4 inhibitors DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-01-02 — — US disclosed
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