SCHEMBL10413895

SCHEMBL10413895

CCOC(=O)c1cn(CC)c2nc(C3=CCN(C(C)=O)CC3)c(F)cc2c1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.49
▸ HPGD P15428 4/20 0.49
▸ HTT P42858 2/20 0.49
▸ USP2 O75604 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ TSHR P16473 3/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ ATP6V1B2 P21281 1/20 0.44
▸ TBXA2R P21731 1/20 0.44
▸ EDNRA P25101 1/20 0.44
▸ TARBP2 Q15633 1/20 0.44
▸ KMT2A Q03164 3/20 0.43
▸ MAPT P10636 2/20 0.42
▸ THRB P10828 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ MAPK1 P28482 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ NPC1 O15118 1/20 0.41

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
SCHEMBL10412667 0.93 LMNA (0.49) LMNAHPGDHTTUSP2ALDH1A1
SCHEMBL10413898 0.87 ADRB2 (0.44) LMNAHPGDHTTUSP2ALDH1A1
SCHEMBL10413303 0.85 KMT2A (0.44) LMNAHPGDHTTUSP2ALDH1A1
SCHEMBL10413402 0.83 HSD17B10 (0.56) LMNAHPGDHTTALDH1A1KDM4E
SCHEMBL10413903 0.78 KDM4E (0.41) LMNAHPGDALDH1A1KDM4EHSD17B10
SCHEMBL3977245 0.76 ALDH1A1 (0.53) LMNAHPGDHTTALDH1A1KDM4E
SCHEMBL10980975 0.76 ALDH1A1 (0.52) LMNAHPGDHTTALDH1A1KDM4E
SCHEMBL11092618 0.75 LMNA (0.61) LMNAHPGDHTTALDH1A1KDM4E
SCHEMBL11286741 0.75 ALDH1A1 (0.53) LMNAHPGDHTTALDH1A1KDM4E
SCHEMBL10414001 0.75 KDM4E (0.46) LMNAHPGDHTTUSP2ALDH1A1

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-4945160-A Preparation of certain 7-substituted quinolones WARNER-LAMBERT COMPANY (US) 1990-07-31 — — US disclosed
Send feedback