SCHEMBL5515475

SCHEMBL5515475

Oc1cccc(F)c1NC(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.35
PTGS2 P35354 1/20 0.35
ALDH1A1 P00352 2/20 0.34
PDK2 Q15119 1/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
PDE4D Q08499 1/20 0.33
ADAMTS4 O75173 1/20 0.33
EGFR P00533 1/20 0.33
LMNA P02545 1/20 0.33
FYN P06241 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
MMP8 P22894 1/20 0.33
CA6 P23280 1/20 0.33
CDK2 P24941 1/20 0.33
MMP12 P39900 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL5514337 0.75 KDM4E (0.32) CA6CA9HSD17B1HSD17B2CES2
SCHEMBL5518501 0.75 RET (0.35) CA6CA9HSD17B1HSD17B2KDM4E
SCHEMBL28918926 0.75 GAA (0.42) PTGS2PDK2LMNACYP3A4CYP2D6
SCHEMBL22989906 0.74 CA2 (0.38) KMT2AALDH1A1CA1CA2PDE4D
SCHEMBL5509830 0.74 ERN1 (0.33) CA6CA9ERN1
SCHEMBL5512079 0.74 PDE4D (0.38) KMT2AALDH1A1CA1CA2PDE4D
SCHEMBL5522062 0.71 CA9 (0.37) KMT2ACA1CA6CA12CA9
SCHEMBL5514103 0.71 ADRB1 (0.36) KMT2AALDH1A1CA1CA2ADAMTS4
SCHEMBL16176784 0.69 KMT2A (0.50) KMT2AALDH1A1CA1CA2PDE4D
SCHEMBL21186770 0.69 ERN1 (0.42) KMT2AALDH1A1CA1CA2PDE4D

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7208559-B2 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2007-04-24 US disclosed
US-20060135712-A1 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2006-06-22 US disclosed