SCHEMBL25125149

SCHEMBL25125149

CC1(C)c2ccccc2-c2cccc(Nc3ccccc3-c3ccc4sc5ccccc5c4c3)c21

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.36
▸ PARP14 Q460N5 1/20 0.34
▸ GPR3 P46089 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ PTGIR P43119 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ IDO1 P14902 1/20 0.30
▸ TDO2 P48775 1/20 0.30
▸ PTPN7 P35236 1/20 0.30
▸ DUSP3 P51452 1/20 0.30
▸ PTPN12 Q05209 1/20 0.30
▸ PTPN22 Q9Y2R2 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
SCHEMBL21446535 0.93 ALOX5 (0.36) ALOX5PARP14GPR3MAPTALDH1A1
SCHEMBL21446536 0.84 PTGIR (0.37) ALOX5PARP14GPR3MAPTALDH1A1
SCHEMBL22680494 0.82 PARP14 (0.35) PARP14GPR3MAPTPOLBTDP1
SCHEMBL22680674 0.82 PARP14 (0.46) ALOX5PARP14GPR3MAPTIDO1
SCHEMBL22680001 0.81 MAPT (0.36) ALOX5PARP14GPR3MAPTALDH1A1
SCHEMBL21446554 0.81 PARP14 (0.33) ALOX5PARP14GPR3MAPTALDH1A1
SCHEMBL25858267 0.80 PDK2 (0.36) —
SCHEMBL17968618 0.80 FABP3 (0.43) ALOX5PARP14GPR3MAPTALDH1A1
SCHEMBL23376462 0.79 ALOX5 (0.36) ALOX5GPR3MAPTALDH1A1POLB
SCHEMBL25125115 0.79 HSP90AA1 (0.39) ALOX5MAPTALDH1A1CYP1A2IDO1

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
Send feedback