SCHEMBL29092373

SCHEMBL29092373

C[C@@H](Oc1cc2c(I)nn([C@H]3CCCCO3)c2cc1F)c1c(Cl)cncc1Cl

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
RET P07949 1/20 0.33
ATR Q13535 3/20 0.32
DGAT2 Q96PD7 1/20 0.30
KDR P35968 1/20 0.30
ETV6 P41212 1/20 0.30
JAK2 O60674 1/20 0.30
MET P08581 1/20 0.30

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
SCHEMBL27187897 1.00 CYP4F2 (0.33) CYP4F2CYP4A11RETATRDGAT2
SCHEMBL27187892 1.00 CYP4F2 (0.33) CYP4F2CYP4A11RETATRDGAT2
SCHEMBL31327358 0.90 CYP4F2 (0.34) CYP4F2CYP4A11RETATRDGAT2
SCHEMBL27188227 0.90 RET (0.33) RETATRDGAT2KDRETV6
SCHEMBL27188228 0.90 RET (0.33) RETATRDGAT2KDRETV6
SCHEMBL24607100 0.90 CYP4F2 (0.33) CYP4F2CYP4A11RET
SCHEMBL29712243 0.90 RET (0.33) RETATRDGAT2KDRETV6
SCHEMBL30713626 0.85 CYP4F2 (0.34) CYP4F2CYP4A11RETATRDGAT2
SCHEMBL30540816 0.84 RET (0.34) CYP4F2CYP4A11RETATR
SCHEMBL29278315 0.84 KDR (0.40) KDRETV6

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
CN-116761798-A Indazoles as kinase inhibitors 泰拉生物科学公司 2023-09-15 CN disclosed