SCHEMBL30279202

SCHEMBL30279202

O=C(O)Cn1ccc2cc(F)cc(Br)c2c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.42
▸ MIF P14174 1/20 0.38
▸ PPARG P37231 2/20 0.38
▸ PPARD Q03181 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ ITGB3 P05106 1/20 0.37
▸ ITGA2B P08514 1/20 0.37
▸ PKM P14618 1/20 0.36
▸ GPR17 Q13304 1/20 0.36
▸ PSMB1 P20618 1/20 0.34
▸ PSMB5 P28074 1/20 0.34
▸ AKR1B10 O60218 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ AKR1A1 P14550 1/20 0.33
▸ AKR1B1 P15121 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33

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
SCHEMBL25073869 1.00 KMT2A (0.42) KMT2AMIFPPARGPPARDPPARA
SCHEMBL25073871 0.82 KDM4E (0.43) NPC1KDM4EALDH1A1POLB
SCHEMBL30279192 0.82 KDM4E (0.43) NPC1KDM4EALDH1A1POLB
SCHEMBL30279156 0.80 PSMB1 (0.41) KMT2APSMB1PSMB5MEN1NPC1
SCHEMBL25073870 0.80 PSMB1 (0.41) KMT2APSMB1PSMB5MEN1NPC1
SCHEMBL25073776 0.79 KMT2A (0.51) KMT2AITGB3ITGA2BPSMB1PSMB5
SCHEMBL30279190 0.79 KMT2A (0.51) KMT2AITGB3ITGA2BPSMB1PSMB5
SCHEMBL31096322 0.71 KMT2A (0.42) KMT2AMIFPPARGPPARDPPARA
SCHEMBL23850234 0.71 KMT2A (0.42) KMT2AMIFPPARGPPARDPPARA
SCHEMBL1576340 0.71 KMT2A (0.60) KMT2APPARGPPARDPPARAKDM4E

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
EP-4387963-A1 PHENYL- AND PYRIDOPYRAZOLE DERIVATIVES AS INHIBITORS OF DDR1 Redx Pharma Limited (GB) 2024-06-26 — — EP disclosed
CN-117813297-A Phenyl and pyridopyrazole derivatives as DDR1 inhibitors 莱德克斯制药公共有限公司 2024-04-02 — — CN disclosed
WO-2023021278-A1 PHENYL- AND PYRIDOPYRAZOLE DERIVATIVES AS INHIBITORS OF DDR1 REDX PHARMA PLC (GB) 2023-02-23 — — WO disclosed
Send feedback