SCHEMBL28449648

SCHEMBL28449648

O=C(O)Cc1nc(-c2cccc(Cl)c2)no1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 1/20 0.69
▸ RAB9A P51151 4/20 0.60
▸ NPC1 O15118 3/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ KMT2A Q03164 3/20 0.58
▸ KCNH2 Q12809 1/20 0.54
▸ TSHR P16473 1/20 0.52
▸ GRM5 P41594 4/20 0.52
▸ ALDH1A1 P00352 3/20 0.51
▸ LMNA P02545 2/20 0.51
▸ MAPT P10636 2/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ MEN1 O00255 1/20 0.49
▸ GLA P06280 1/20 0.49

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
SCHEMBL1544736 0.86 TSHR (0.71) FFAR1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL4611029 0.84 ALDH1A1 (0.68) FFAR1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL4658742 0.82 KCNH2 (0.64) FFAR1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL1544555 0.82 KMT2A (0.56) FFAR1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL5759070 0.81 TSHR (0.64) FFAR1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL1544535 0.81 RAB9A (0.55) FFAR1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL30566758 0.81 RAB9A (0.55) FFAR1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL1544588 0.80 RAB9A (0.57) FFAR1RAB9ANPC1L3MBTL1KMT2A
SCHEMBL11555365 0.80 AKR1B1 (0.51) FFAR1KMT2ATSHRALDH1A1LMNA
SCHEMBL8293860 0.80 NOTUM (0.67) FFAR1RAB9ANPC1L3MBTL1KMT2A

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-111630032-B Novel methionine metabolic pathway inhibitor 米加尔-加利里研究院有限公司 2024-06-07 — — CN disclosed
CN-111699182-A Novel methionine metabolic pathway inhibitors 米加尔-加利里研究院有限公司 2020-09-22 — — CN disclosed
CN-111630032-A Novel methionine metabolic pathway inhibitors 米加尔-加利里研究院有限公司 2020-09-04 — — CN disclosed
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