SCHEMBL28598372

SCHEMBL28598372

[CH2]c1cc(-c2ccc(C)cc2)nc2ccc(OC)cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ MAPT P10636 5/20 0.54
▸ PLA2G2A P14555 3/20 0.53
▸ ACP1 P24666 1/20 0.52
▸ TP53 P04637 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ ACACA Q13085 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ EGFR P00533 1/20 0.49
▸ KDR P35968 1/20 0.49
▸ AURKA O14965 1/20 0.47
▸ AURKB Q96GD4 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46

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
SCHEMBL875697 0.85 KDM4E (0.58) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL14500755 0.76 NPC1 (0.59) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL14264120 0.76 ACACA (0.69) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL14264119 0.75 ACACA (0.72) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL10263305 0.75 KDM4E (0.73) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL29636809 0.75 KDM4E (0.65) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL4480591 0.75 PLA2G2A (0.64) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL4496204 0.75 KDM4E (0.65) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL4482092 0.75 PLA2G2A (0.60) KDM4EMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL6534420 0.74 KDM4E (0.55) KDM4EMEN1KMT2ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114751920-B Antitumor compounds 法马马有限公司 2024-06-07 — — CN disclosed
CN-114736219-B Antitumor compounds 法马马有限公司 2024-06-07 — — CN disclosed
CN-118139851-A Antitumor compounds 法马马有限公司 2024-06-04 — — CN disclosed
CN-117865987-A Antitumor compounds 法马马有限公司 2024-04-12 — — CN disclosed
CN-114615999-B Drug antibody conjugates 法马马有限公司 2024-03-08 — — CN disclosed
CN-114751920-A Antitumor compounds 法马马有限公司 2022-07-15 — — CN disclosed
CN-114736219-A Antitumor compounds 法马马有限公司 2022-07-12 — — CN disclosed
CN-114615999-A Drug antibody conjugates 法马马有限公司 2022-06-10 — — CN disclosed
CN-113226377-A Antibody drug conjugates comprising an eltrinastine derivative 法马马有限公司 2021-08-06 — — CN disclosed
CN-113166102-A Anticancer compounds 法马马有限公司 2021-07-23 — — CN disclosed
CN-111556872-A Synthesis of boronic ester derivatives and uses thereof 梅琳塔治疗公司 2020-08-18 — — CN disclosed
CN-110621678-A Antitumor compounds 法马马有限公司 2019-12-27 — — CN disclosed
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