SCHEMBL25124677

SCHEMBL25124677

CC1(C)c2ccccc2-c2c(Nc3ccccc3-c3ccccc3-c3ccccc3)cccc21

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 8/20 0.39
▸ FABP3 P05413 6/20 0.39
▸ FABP5 Q01469 3/20 0.39
▸ PDK2 Q15119 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MYC P01106 2/20 0.33
▸ SIGMAR1 Q99720 2/20 0.33
▸ MAX P61244 1/20 0.33
▸ ADRA2A P08913 1/20 0.32
▸ HTR7 P34969 1/20 0.32
▸ ADRA1A P35348 1/20 0.32
▸ HNF4A P41235 1/20 0.32
▸ BUB1 O43683 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
SCHEMBL17777676 0.94 FABP4 (0.44) FABP4FABP3FABP5PDK2ALDH1A1
SCHEMBL29598725 0.94 FABP4 (0.44) FABP4FABP3FABP5PDK2ALDH1A1
SCHEMBL25125269 0.91 FABP4 (0.42) FABP4FABP3FABP5PDK2ALDH1A1
SCHEMBL26066397 0.90 FABP4 (0.43) FABP4FABP3FABP5PDK2MYC
SCHEMBL25124663 0.89 FABP4 (0.35) FABP4FABP3FABP5PDK2ALDH1A1
SCHEMBL25124653 0.89 TYMS (0.36) FABP4FABP3FABP5PDK2ALDH1A1
SCHEMBL29771223 0.87 PDK2 (0.45) FABP4PDK2ADRA2AADRA1A
SCHEMBL23637475 0.87 PDK2 (0.45) FABP4PDK2ADRA2AADRA1A
SCHEMBL22517272 0.86 MYC (0.36) FABP4FABP3FABP5PDK2ALDH1A1
SCHEMBL15250343 0.86 PDK2 (0.39) FABP4FABP3FABP5PDK2ALDH1A1

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-11711973-B2 Organic electronic device DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 — — US disclosed
US-11711973-B2 Organic electronic device DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 — — US disclosed
US-20230111469-A1 Organic Electronic Device DUK SAN NEOLUX CO., LTD. (KR) 2023-04-13 — — US disclosed
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