SCHEMBL26868249

SCHEMBL26868249

CC(c1cc(N)n2ncc(C(F)(F)F)c2n1)C1CC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP3K12 Q12852 9/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ CCNA2 P20248 6/20 0.31
▸ CDK2 P24941 6/20 0.31
▸ CCNA1 P78396 6/20 0.31
▸ CHEK1 O14757 4/20 0.31
▸ CCNT1 O60563 2/20 0.31
▸ CDK1 P06493 2/20 0.31
▸ CDK4 P11802 2/20 0.31
▸ CCND1 P24385 2/20 0.31
▸ CCNE1 P24864 2/20 0.31
▸ CDK7 P50613 2/20 0.31
▸ CDK9 P50750 2/20 0.31

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
SCHEMBL26868252 1.00 MAP3K12 (0.33) MAP3K12KDM4EMEN1NPC1MAPT
SCHEMBL26868250 1.00 MAP3K12 (0.33) MAP3K12KDM4EMEN1NPC1MAPT
SCHEMBL26868861 0.95 MAP3K12 (0.33) MAP3K12KDM4EMEN1NPC1MAPT
SCHEMBL26868590 0.95 MAP3K12 (0.35) MAP3K12KDM4EMEN1NPC1MAPT
SCHEMBL26868320 0.84 CHEK1 (0.34) MAP3K12KDM4EMEN1NPC1MAPT
SCHEMBL26868315 0.84 CHEK1 (0.34) MAP3K12KDM4EMEN1NPC1MAPT
SCHEMBL26868318 0.84 CHEK1 (0.34) MAP3K12KDM4EMEN1NPC1MAPT
SCHEMBL26874424 0.83 KDM4E (0.36) KDM4EMEN1NPC1MAPTRAB9A
SCHEMBL26868158 0.82 KDM4E (0.35) KDM4EMEN1NPC1MAPTRAB9A
SCHEMBL26868112 0.82 KDM4E (0.35) KDM4EMEN1NPC1MAPTRAB9A

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
EP-4282868-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE-7-AMINE DERIVATIVE, AND COMPOSITIONS AND MEDICAL USE THEREOF Shanghai Haiyan Pharmaceutical Technology Co., Ltd (CN) 2023-11-29 — — EP disclosed
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