SCHEMBL17255697

SCHEMBL17255697

Cc1nn(-c2ccc(C(N)=O)cc2O)c(C)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
MYC P01106 1/20 0.40
LCK P06239 1/20 0.38
LMNA P02545 1/20 0.37
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 2/20 0.37
HPGD P15428 1/20 0.36
PARP1 P09874 1/20 0.36
KMT2A Q03164 2/20 0.35
CRHR1 P34998 1/20 0.35
AR P10275 1/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
BRD4 O60885 1/20 0.35

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
SCHEMBL15442859 0.87 MYC (0.55) CA12CA1CA2CA9MYC
SCHEMBL15442861 0.86 MEN1 (0.51) MYCLMNAALDH1A1KMT2AAR
SCHEMBL16761057 0.83 CA12 (0.50) CA12CA1CA2CA9MYC
SCHEMBL27993082 0.79 CASP1 (0.47) CA12CA1CA2CA9LMNA
SCHEMBL15443094 0.78 GAA (0.58) CA12CA1CA2CA9MYC
SCHEMBL16761056 0.76 CA9 (0.40) CA12CA1CA2CA9LMNA
SCHEMBL15442468 0.76 CA12 (0.40) CA12CA1CA2CA9MYC
SCHEMBL17255708 0.76 LMNA (0.50) CA12CA1CA2CA9LMNA
SCHEMBL17255678 0.75 KDM4E (0.47) CA12CA1CA2CA9LMNA
SCHEMBL27993294 0.73 SMN1; SMN2 (0.44) ALDH1A1KDM4EHPGDKMT2APDE4B

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
EP-2669274-B1 TOPICAL ANTIFUNGAL AGENT MEIJI SEIKA PHARMA CO LTD (JP) 2015-11-18 EP claimed
CN-104661661-A External liquid preparation for resisting trichophytosis MEIJI SEIKA PHARMA CO LTD 2015-05-27 CN disclosed