SCHEMBL8059262

SCHEMBL8059262

CN(Cc1ccccc1-c1ccccc1)C(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.49
ALOX5 P09917 1/20 0.49
MLYCD O95822 1/20 0.48
CDK4 P11802 2/20 0.47
CCND1 P24385 2/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ATM Q13315 1/20 0.47
ALDH1A1 P00352 1/20 0.47
ESRRG P62508 1/20 0.46
HDAC1 Q13547 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
NR1H4 Q96RI1 3/20 0.44
GRIN2C Q14957 1/20 0.44
TACR1 P25103 1/20 0.44
PPARD Q03181 1/20 0.43

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
SCHEMBL7553631 0.87 KMT2A (0.55) MEN1KMT2AATMALDH1A1HDAC1
SCHEMBL21923501 0.80 MLYCD (0.70) PTGESALOX5MLYCDMEN1KMT2A
SCHEMBL8751750 0.77 ALDH1A1 (0.55) MEN1KMT2AALDH1A1TACR1
SCHEMBL6414972 0.75 SLC6A2 (0.52) MEN1KMT2AALDH1A1TACR1
SCHEMBL8041553 0.75 TACR1 (0.63) PTGESALOX5MEN1KMT2AALDH1A1
SCHEMBL9313621 0.74 CDK4 (0.51) PTGESALOX5MLYCDCDK4CCND1
SCHEMBL17670742 0.73 HSD17B2 (0.53) CDK4CCND1MEN1KMT2AATM
SCHEMBL3672556 0.73 TACR1 (0.55) MLYCDMEN1KMT2ATACR1
SCHEMBL4406602 0.72 ESRRG (0.59) CDK4CCND1MEN1KMT2AALDH1A1
SCHEMBL25375884 0.72 KMT2A (0.47) MEN1KMT2AALDH1A1TACR1

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-6015925-A TREATING MYCOSIS POLA CHEMICAL INDUSTRIES, INC. (JP) 2000-01-18 US disclosed