SCHEMBL13137304

SCHEMBL13137304

Cc1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(N(c4ccc(C)cc4)c4cccc5ccccc45)ccc2-3)c2cccc3ccccc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.33
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2A6 P11509 1/20 0.32
▸ MAOA P21397 1/20 0.31
▸ L3MBTL1 Q9Y468 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
SCHEMBL13137301 0.96 SIGMAR1 (0.35) SIGMAR1CYP1A2CYP2A6MAOAL3MBTL1
SCHEMBL13137314 0.94 PDK2 (0.32) SIGMAR1
SCHEMBL13137323 0.94 SIGMAR1 (0.32) SIGMAR1CYP1A2CYP2A6
SCHEMBL17465387 0.93 PDK2 (0.36) SIGMAR1
SCHEMBL13137300 0.92 SIGMAR1 (0.36) SIGMAR1L3MBTL1
SCHEMBL29393038 0.92 SIGMAR1 (0.36) SIGMAR1L3MBTL1
SCHEMBL12640112 0.91 SIGMAR1 (0.35) SIGMAR1CYP1A2L3MBTL1
SCHEMBL13137340 0.91 SIGMAR1 (0.33) SIGMAR1
SCHEMBL13137353 0.91 SIGMAR1 (0.31) SIGMAR1CYP1A2CYP2A6
SCHEMBL13374509 0.90 CRHR1 (0.33) —

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-7799440-B2 Organic electroluminescent device and host material of luminescent and hole-blocking material thereof CHI MEI OPTOELECTRONICS CORP. (TW) 2010-09-21 — — US disclosed
US-7799440-B2 Organic electroluminescent device and host material of luminescent and hole-blocking material thereof CHI MEI OPTOELECTRONICS CORP. (TW) 2010-09-21 — — US disclosed
US-20070015005-A1 Organic electroluminescent device and host material of luminescent and hole-blocking material thereof CHI MEI OPTOELECTRONICS CORP. (TW) 2007-01-18 — — US disclosed
US-20070015005-A1 Organic electroluminescent device and host material of luminescent and hole-blocking material thereof CHI MEI OPTOELECTRONICS CORP. (TW) 2007-01-18 — — US disclosed
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