SCHEMBL28361064

SCHEMBL28361064

O=C1CC(c2ccccc2)CN1c1cnn2c1CN(C(=O)Nc1cc(F)c(F)c(F)c1)C(C1CC1)C2

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CSNK1D P48730 1/20 0.36
▸ CSNK1E P49674 1/20 0.36
▸ HTR6 P50406 5/20 0.34
▸ TP53 P04637 2/20 0.34
▸ GRIN2B Q13224 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ GRM4 Q14833 2/20 0.33
▸ NPC1 O15118 3/20 0.33
▸ RAB9A P51151 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ LMNA P02545 1/20 0.31
▸ ALDH1A1 P00352 1/20 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
SCHEMBL28361041 0.94 CSNK1D (0.36) CSNK1DCSNK1EGRIN2BGRM4NPC1
SCHEMBL28357358 0.92 GRM4 (0.42) CSNK1DCSNK1EGRIN2BGRM4LMNA
SCHEMBL28361088 0.91 HTR6 (0.33) HTR6TP53GRIN2BSMN1; SMN2GRM4
SCHEMBL17925514 0.89 SMN1; SMN2 (0.35) HTR6TP53GRIN2BSMN1; SMN2GRM4
SCHEMBL28361004 0.89 CSNK1D (0.35) CSNK1DCSNK1EGRM4
SCHEMBL28357469 0.87 CSNK1D (0.36) CSNK1DCSNK1ETP53GRIN2BSMN1; SMN2
SCHEMBL28361300 0.87 CSNK1D (0.35) CSNK1DCSNK1E
SCHEMBL28361100 0.87 CSNK1D (0.35) CSNK1DCSNK1EGRM4
SCHEMBL28361097 0.86 CSNK1D (0.35) CSNK1DCSNK1EHTR6GRIN2BSMN1; SMN2
SCHEMBL28357366 0.85 CSNK1D (0.35) CSNK1DCSNK1E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110804061-B Pyrazole and pyrazine formamide compound containing cyclopropyl segment and application thereof 中国医学科学院医药生物技术研究所 2021-01-05 — — CN claimed
CN-110804061-A Pyrazole and pyrazine formamide compound containing cyclopropyl segment and application thereof 中国医学科学院医药生物技术研究所 2020-02-18 — — CN claimed
CN-110804061-B Pyrazole and pyrazine formamide compound containing cyclopropyl segment and application thereof 中国医学科学院医药生物技术研究所 2021-01-05 — — CN disclosed
CN-110804061-A Pyrazole and pyrazine formamide compound containing cyclopropyl segment and application thereof 中国医学科学院医药生物技术研究所 2020-02-18 — — CN disclosed
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