SCHEMBL15977641

SCHEMBL15977641

c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc(-c5cc(-c6cccc7ccccc67)ccn5)cc4)ccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.42
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
PRKDC P78527 2/20 0.40
TGFBR1 P36897 1/20 0.39
MCL1 Q07820 1/20 0.39
ACMSD Q8TDX5 1/20 0.39
ENPP3 O14638 1/20 0.39
ENPP1 P22413 1/20 0.39
CCNT1 O60563 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CDK9 P50750 1/20 0.38
TNF P01375 1/20 0.38
SMO Q99835 2/20 0.37
PIM1 P11309 1/20 0.37
PLG P00747 1/20 0.37
PLAU P00749 1/20 0.37

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
SCHEMBL10300899 0.95 CCNT1 (0.41) PIK3CACA12CA1CA2CA9
SCHEMBL9613007 0.91 CA12 (0.40) PIK3CACA12CA1CA2CA9
SCHEMBL15977450 0.90 PIM1 (0.40) PIK3CACA12CA1CA2CA9
SCHEMBL18160975 0.90 ENPP1 (0.42) CA12CA1CA2CA9PRKDC
SCHEMBL18563322 0.89 HSD17B10 (0.44) CA12CA1CA2CA9TGFBR1
SCHEMBL10300923 0.88 ASIC3 (0.46) PIK3CAPRKDCTGFBR1SMOPIM1
SCHEMBL15977471 0.88 ASIC3 (0.46) PIK3CAPRKDCTGFBR1SMOPIM1
SCHEMBL10300991 0.87 MCL1 (0.42) CA12CA1CA2CA9MCL1
SCHEMBL10300974 0.87 ASIC3 (0.47) PIK3CAPRKDCTGFBR1SMOPIM1
SCHEMBL17320791 0.86 KDM4E (0.46) PIK3CAPRKDCTGFBR1TNFPIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9559311-B2 Anthracene derivative, organic-electroluminescence-device material, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2017-01-31 US disclosed
US-9559311-B2 Anthracene derivative, organic-electroluminescence-device material, organic electroluminescence device, and electronic equipment IDEMITSU KOSAN CO., LTD. (JP) 2017-01-31 US disclosed
US-20140239273-A1 ANTHRACENE DERIVATIVE, ORGANIC-ELECTROLUMINESCENCE-DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-08-28 US disclosed
US-20140239273-A1 ANTHRACENE DERIVATIVE, ORGANIC-ELECTROLUMINESCENCE-DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC EQUIPMENT IDEMITSU KOSAN CO., LTD. (JP) 2014-08-28 US disclosed