SCHEMBL18119083

SCHEMBL18119083

c1ccc(-c2ccc3c(c2)c2c4c(ccc2n3-c2cccc3ccccc23)sc2ccccc24)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 1/20 0.32
▸ F9 P00740 2/20 0.32
▸ GSK3A P49840 1/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ PIM3 Q86V86 1/20 0.32
▸ ROCK1 Q13464 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ CDK4 P11802 1/20 0.30
▸ CCND1 P24385 1/20 0.30
▸ TSPO P30536 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ MCL1 Q07820 1/20 0.30

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
SCHEMBL18119065 1.00 LIMK1 (0.32) LIMK1F9GSK3AGSK3BCYP1A1
SCHEMBL18119155 0.98 TDP1 (0.33) GSK3AGSK3BTDP1POLBALDH1A1
SCHEMBL18119153 0.96 TDP1 (0.34) GSK3AGSK3BTDP1POLBALDH1A1
SCHEMBL23862356 0.93 GSK3A (0.32) GSK3AGSK3BTDP1POLBTSPO
SCHEMBL19653199 0.93 KDM4E (0.33) TSPOKDM4E
SCHEMBL23862193 0.93 KDM4E (0.33) TSPOKDM4E
SCHEMBL18119168 0.92 ALOX5 (0.32) F9GSK3AGSK3BTDP1POLB
SCHEMBL18119559 0.92 TDP1 (0.34) GSK3AGSK3BTDP1POLB
SCHEMBL17760062 0.92 KDM4E (0.33) TSPOKDM4E
SCHEMBL19653696 0.92 KDM4E (0.33) TSPOKDM4E

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-10361372-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2019-07-23 — — US disclosed
US-20160293845-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-10-06 — — US disclosed
US-20160293845-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-10-06 — — US disclosed
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