SCHEMBL29644366

SCHEMBL29644366

c1cc(Oc2ccc3cn[nH]c3c2)ccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ DYRK1A Q13627 2/20 0.47
▸ METAP2 P50579 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ FGFR1 P11362 5/20 0.46
▸ CLK1 P49759 1/20 0.46
▸ TLR8 Q9NR97 1/20 0.46
▸ BRAF P15056 1/20 0.43
▸ FGFR2 P21802 2/20 0.42
▸ FGFR3 P22607 2/20 0.42
▸ TNK2 Q07912 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ F2 P00734 1/20 0.42
▸ CYP3A4 P08684 2/20 0.41
▸ LMNA P02545 1/20 0.41

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
SCHEMBL26979386 1.00 NOS1 (0.47) NOS1MAPTDYRK1AMETAP2KDM4E
SCHEMBL13923957 0.85 FGFR1 (0.57) NOS1MAPTDYRK1AMETAP2KDM4E
SCHEMBL17423783 0.83 FGFR1 (0.57) NOS1MAPTDYRK1AMETAP2KDM4E
SCHEMBL2933092 0.79 NR4A1 (0.55) NOS1MAPTDYRK1AMETAP2KDM4E
SCHEMBL27975732 0.77 MAPT (0.70) NOS1MAPTDYRK1AMETAP2KDM4E
SCHEMBL31052754 0.75 KDM4E (0.60) NOS1MAPTDYRK1AMETAP2KDM4E
SCHEMBL20721442 0.75 MAPT (0.53) NOS1MAPTDYRK1AMETAP2KDM4E
SCHEMBL252796 0.75 KDM4E (0.60) NOS1MAPTDYRK1AMETAP2KDM4E
Hydrochloric Acid SCHEMBL29920009 0.74 KDM4E (0.58) NOS1MAPTDYRK1AMETAP2KDM4E
SCHEMBL27976107 0.74 CLK1 (0.74) NOS1MAPTDYRK1AMETAP2KDM4E

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
CN-116867768-A STING antagonists and uses thereof 上海齐鲁锐格医药研发有限公司 2023-10-10 — — CN disclosed
EP-4247790-A1 STING ANTAGONISTS AND USES THEREOF Qilu Regor Therapeutics Inc. (CN) 2023-09-27 — — EP disclosed
WO-2022105930-A1 STING ANTAGONISTS AND USES THEREOF QILU REGOR THERAPEUTICS INC. (CN) 2022-05-27 — — WO disclosed
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