Olverembatinib

Olverembatinib

SCHEMBL30456095

Br.Cc1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)c(C(F)(F)F)c2)cc1C#Cc1cnc2[nH]ncc2c1

nearest known ligand 0.99

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1BCR

The experimentally established mechanism targets of Olverembatinib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ABL1 known ✓ P00519 17/20 0.99
▸ FGFR1 P11362 1/20 0.99
▸ CYP2C9 P11712 1/20 0.99
▸ PDGFRA P16234 1/20 0.99
▸ CYP2C19 P33261 1/20 0.99
▸ FLT3 P36888 1/20 0.99
▸ LRRK2 Q5S007 1/20 0.99
▸ HDAC6 Q9UBN7 1/20 0.99
▸ KIT P10721 3/20 0.78

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
Olverembatinib SCHEMBL3424528 0.99 ABL1 (1.00) ABL1FGFR1CYP2C9PDGFRACYP2C19
Olverembatinib SCHEMBL29387193 0.99 ABL1 (1.00) ABL1FGFR1CYP2C9PDGFRACYP2C19
Olverembatinib SCHEMBL29514988 0.99 ABL1 (1.00) ABL1FGFR1CYP2C9PDGFRACYP2C19
Olverembatinib SCHEMBL14953130 0.99 ABL1 (0.99) ABL1FGFR1CYP2C9PDGFRACYP2C19
Olverembatinib SCHEMBL29515011 0.99 ABL1 (0.99) ABL1FGFR1CYP2C9PDGFRACYP2C19
Olverembatinib SCHEMBL29652687 0.96 ABL1 (0.94) ABL1FGFR1CYP2C9PDGFRACYP2C19
Olverembatinib SCHEMBL14953403 0.96 ABL1 (0.94) ABL1FGFR1CYP2C9PDGFRACYP2C19
Olverembatinib SCHEMBL29464044 0.96 ABL1 (0.94) ABL1FGFR1CYP2C9PDGFRACYP2C19
Olverembatinib SCHEMBL30456239 0.95 ABL1 (0.92) ABL1FGFR1CYP2C9PDGFRACYP2C19
SCHEMBL22699129 0.94 ABL1 (0.90) ABL1FGFR1CYP2C9PDGFRACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230106142-A1 CRYSTALS OF ALKYNYL-CONTAINING COMPOUND, SALT AND SOLVATE THEREOF, PREPARATION METHOD, AND APPLICATIONS ASCENTAGE PHARMA GROUP CORP LIMITED (CN) 2023-04-06 — — US disclosed
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