SCHEMBL16133159

SCHEMBL16133159

c1ccc(-c2cccc3c2sc2c(-c4cccc(-c5cc6c7ccccc7c7cccc8c9ccccc9c(c5)c6c78)c4)cccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 3/20 0.43
ALOX5 P09917 1/20 0.42
MAP3K8 P41279 4/20 0.33
F9 P00740 1/20 0.33
TDO2 P48775 1/20 0.33
S1PR4 O95977 1/20 0.33
S1PR5 Q9H228 1/20 0.33
MAPK1 P28482 2/20 0.33
MAP2K1 Q02750 1/20 0.33
PRKDC P78527 1/20 0.33
MCL1 Q07820 1/20 0.32
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32
PTGER1 P34995 1/20 0.32
PTGER4 P35408 1/20 0.32
PTGER3 P43115 1/20 0.32
PTGER2 P43116 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL16133161 0.92 ALOX5 (0.44) LIMK1ALOX5MAP3K8F9TDO2
SCHEMBL16133164 0.92 LIMK1 (0.47) LIMK1ALOX5F9TDO2MAPK1
SCHEMBL16133166 0.89 ALOX5 (0.47) LIMK1ALOX5F9TDO2S1PR4
SCHEMBL16133160 0.88 ALOX5 (0.48) LIMK1ALOX5MAP3K8F9PRKDC
SCHEMBL16133152 0.88 ALOX5 (0.57) LIMK1ALOX5F9PRKDCALDH1A1
SCHEMBL16133167 0.87 CYP1A1 (0.45) LIMK1ALOX5S1PR4S1PR5MAPK1
SCHEMBL1687987 0.87 ALOX5 (0.48) LIMK1ALOX5MAP3K8F9TDO2
SCHEMBL21157788 0.87 ALOX5 (0.49) LIMK1ALOX5MAP3K8TDO2S1PR4
SCHEMBL16133156 0.87 ALOX5 (0.49) LIMK1ALOX5F9PRKDCMCL1
SCHEMBL17425730 0.86 ALOX5 (0.47) LIMK1ALOX5MAP3K8F9S1PR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9997712-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-06-12 US disclosed
US-9997712-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-06-12 US disclosed
US-20140291638-A1 HOST MATERIALS FOR OLED APPLICATION UNIVERSAL DISPLAY CORPORATION (US) 2014-10-02 US disclosed