SCHEMBL28593549

SCHEMBL28593549

COc1ccc2c3c(cccc13)C(=O)N(c1ccc(O)cc1)C2=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 8/20 0.66
▸ POLB P06746 5/20 0.66
▸ ALDH1A1 P00352 4/20 0.66
▸ KDM4E B2RXH2 4/20 0.66
▸ LMNA P02545 2/20 0.66
▸ HTT P42858 2/20 0.66
▸ MAPT P10636 1/20 0.66
▸ PABPC1 P11940 1/20 0.66
▸ XBP1 P17861 1/20 0.66
▸ NFKB1 P19838 1/20 0.66
▸ SMARCA2 P51531 1/20 0.66
▸ NFKB2 Q00653 1/20 0.66
▸ RELA Q04206 1/20 0.66
▸ PRMT1 Q99873 1/20 0.63
▸ MEN1 O00255 6/20 0.58
▸ USP2 O75604 4/20 0.58
▸ APAF1 O14727 1/20 0.58
▸ NPC1 O15118 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ ATM Q13315 1/20 0.54

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
SCHEMBL20735077 0.93 PRMT1 (0.72) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL20735000 0.89 PRMT1 (0.67) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL20735190 0.89 PRMT1 (0.67) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL17948241 0.87 PRMT1 (0.68) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL20735084 0.84 PRMT1 (0.60) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL28588306 0.81 USP2 (0.78) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL14159132 0.80 POLB (0.65) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL7703824 0.80 KMT2A (1.00) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL20735062 0.79 PRMT1 (0.68) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL14159196 0.79 POLB (0.63) KMT2APOLBALDH1A1KDM4ELMNA

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
CN-113024463-B Preparation and application of 1, 8-naphthalimide hydrogen sulfide fluorescent molecular probe 天津大学 2022-05-10 — — CN claimed
CN-113024463-A Preparation and application of 1, 8-naphthalimide hydrogen sulfide fluorescent molecular probe 天津大学 2021-06-25 — — CN claimed
CN-113024463-B Preparation and application of 1, 8-naphthalimide hydrogen sulfide fluorescent molecular probe 天津大学 2022-05-10 — — CN disclosed
CN-113024463-A Preparation and application of 1, 8-naphthalimide hydrogen sulfide fluorescent molecular probe 天津大学 2021-06-25 — — CN disclosed
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