SCHEMBL11201349

SCHEMBL11201349

CCOC(=O)c1cn(CCF)c2nc(N3CCC(NC(C)=O)C3)c(F)cc2c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ ATP6V1B2 P21281 1/20 0.45
▸ TBXA2R P21731 1/20 0.45
▸ EDNRA P25101 1/20 0.45
▸ TARBP2 Q15633 1/20 0.45
▸ DYRK3 O43781 1/20 0.42
▸ PIM3 Q86V86 1/20 0.42
▸ SRPK1 Q96SB4 1/20 0.42
▸ CSNK1G1 Q9HCP0 1/20 0.42
▸ ALDH1A1 P00352 6/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ HPGD P15428 3/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ OPRK1 P41145 2/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ ATM Q13315 1/20 0.40
▸ SMPD3 Q9NY59 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL11288252 0.94 LMNA (0.52) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL10653881 0.88 DPP4 (0.48) LMNADYRK3PIM3SRPK1CSNK1G1
SCHEMBL11196782 0.85 LMNA (0.44) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL10547292 0.84 KMT2A (0.61) LMNADYRK3PIM3SRPK1CSNK1G1
SCHEMBL11276787 0.84 LMNA (0.51) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL11389071 0.84 ALDH1A1 (0.47) LMNAALDH1A1KDM4EHPGDOPRK1
SCHEMBL11282440 0.83 LMNA (0.65) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL8132981 0.83 KMT2A (0.48) LMNADYRK3PIM3SRPK1CSNK1G1
SCHEMBL11008488 0.82 LMNA (0.52) LMNACYP2C9ATP6V1B2TBXA2REDNRA
SCHEMBL11198791 0.81 LMNA (0.56) LMNACYP2C9ATP6V1B2TBXA2REDNRA

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-4382937-A Naphthyridine derivatives and their use as anti-bacterials DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1983-05-10 — — US disclosed
Send feedback