SCHEMBL18214153

SCHEMBL18214153

c1ccc(N(c2ccc3ccc4ccccc4c3c2)c2ccc3c(c2)c2ccccc2c2c4ccc(N(c5ccc6ccc7ccccc7c6c5)c5cccc6ccccc56)cc4sc32)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HPRT1 P00492 3/20 0.33
▸ ERBB2 P04626 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ AHR P35869 1/20 0.31
▸ SIGMAR1 Q99720 1/20 0.30
▸ CYP1A1 P04798 1/20 0.30
▸ CYP1B1 Q16678 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
SCHEMBL17658105 0.96 SIGMAR1 (0.33) HPRT1SIGMAR1CYP1A1CYP1B1
SCHEMBL17658666 0.96 HPRT1 (0.36) HPRT1ERBB2CYP1A2FYNMAOA
SCHEMBL17658305 0.93 HPRT1 (0.35) HPRT1ERBB2CYP1A2FYNMAOA
SCHEMBL17658227 0.93 LIMK1 (0.32) SIGMAR1CYP1A1CYP1B1
SCHEMBL17658267 0.93 LIMK1 (0.32) SIGMAR1CYP1A1CYP1B1
SCHEMBL17658251 0.90 LIMK1 (0.32) SIGMAR1CYP1A1CYP1B1
SCHEMBL17658659 0.90 LIMK1 (0.32) SIGMAR1CYP1A1CYP1B1
SCHEMBL17658237 0.90 LIMK1 (0.32) SIGMAR1CYP1A1CYP1B1
SCHEMBL17658076 0.90 HPRT1 (0.34) HPRT1ERBB2CYP1A2FYNMAOA
SCHEMBL18214142 0.90 HPRT1 (0.34) HPRT1ERBB2CYP1A2FYNMAOA

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-9923147-B2 Organic light emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-20 — — US disclosed
US-9923147-B2 Organic light emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-20 — — US disclosed
US-20160329501-A1 ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-11-10 — — US disclosed
US-20160329501-A1 ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-11-10 — — US disclosed
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