SCHEMBL10587639

SCHEMBL10587639

O=C1c2c(Nc3ccc(Cl)cc3)ccc(Nc3ccc(Cl)cc3)c2C(=O)c2c(Nc3ccc(Cl)cc3)ccc(Nc3ccc(Cl)cc3)c21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.44
▸ DHODH Q02127 1/20 0.43
▸ PTGS1 P23219 2/20 0.42
▸ PTGS2 P35354 2/20 0.42
▸ AKR1C3 P42330 1/20 0.42
▸ AKR1C2 P52895 1/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ MT-CO2 P00403 1/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ GSK3B P49841 2/20 0.40
▸ PTPRA P18433 1/20 0.40
▸ PTPRB P23467 1/20 0.40
▸ P2RY4 P51582 1/20 0.39

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
SCHEMBL9438061 0.91 RAB9A (0.47) LMNAPTGS1PTGS2AKR1C3AKR1C2
SCHEMBL9438094 0.91 RAB9A (0.47) LMNAPTGS1PTGS2AKR1C3AKR1C2
SCHEMBL9438202 0.81 BACE1 (0.49) LMNAL3MBTL1MEN1KMT2AMAPT
SCHEMBL10587610 0.80 MEN1 (0.41) LMNAPTGS2L3MBTL1MEN1KMT2A
SCHEMBL11602772 0.79 DHODH (0.49) LMNADHODHL3MBTL1MEN1KMT2A
SCHEMBL9438085 0.78 NPC1 (0.55) LMNAPTGS1PTGS2AKR1C3AKR1C2
SCHEMBL848233 0.78 CYP3A4 (0.69) LMNAL3MBTL1MEN1KMT2AMAPT
SCHEMBL13962360 0.78 MEN1 (0.48) LMNAL3MBTL1CA1CA2MEN1
SCHEMBL1476308 0.77 PTPRA (0.53) LMNAPTGS1PTGS2L3MBTL1MEN1
SCHEMBL11538183 0.75 MAPT (0.56) LMNADHODHL3MBTL1MEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0323184-A1 Halogenated anthraquinones useful as near infrared absorbing optical filters, and method of making them MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-07-05 — — EP claimed
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