SCHEMBL13754306

SCHEMBL13754306

CCc1ccc(O)c(NC(C)=O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.54
LMNA P02545 3/20 0.54
KDM4E B2RXH2 2/20 0.54
APOBEC3A P31941 1/20 0.54
GFER P55789 1/20 0.54
HDAC1 Q13547 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PHPT1 Q9NRX4 1/20 0.54
TRPA1 O75762 1/20 0.52
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
MAPT P10636 2/20 0.49
ESR1 P03372 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HIF1A Q16665 2/20 0.44

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
SCHEMBL14354734 0.86 CNR1 (0.53) POLBLMNAKDM4EAPOBEC3AGFER
SCHEMBL92190 0.86 POLB (0.62) POLBLMNAKDM4EAPOBEC3AGFER
SCHEMBL13175172 0.86 POLB (0.54) POLBLMNAKDM4EAPOBEC3AGFER
SCHEMBL8787958 0.83 POLB (0.51) POLBLMNAKDM4EAPOBEC3AGFER
SCHEMBL6581850 0.82 ALDH1A1 (0.52) POLBLMNASMN1; SMN2NPC1RAB9A
SCHEMBL4513447 0.81 KDM4E (0.54) POLBLMNAKDM4EAPOBEC3AGFER
SCHEMBL8225325 0.81 SMN1; SMN2 (0.47) POLBLMNAKDM4EHDAC1SMN1; SMN2
SCHEMBL30667032 0.81 ALDH1A1 (0.59) POLBKDM4ESMN1; SMN2CA1CA2
SCHEMBL14405814 0.81 ALDH1A1 (0.59) POLBKDM4ESMN1; SMN2CA1CA2
SCHEMBL16139300 0.80 TRPA1 (0.46) LMNAKDM4ESMN1; SMN2TRPA1CA12

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-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US disclosed
US-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US disclosed