SCHEMBL27430035

SCHEMBL27430035

Cc1ccc(Nc2nc(N3CCOCC3)nc3nccnc23)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.60
▸ CYP1A2 P05177 1/20 0.60
▸ CYP3A4 P08684 1/20 0.60
▸ CYP2C9 P11712 1/20 0.60
▸ CYP2C19 P33261 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ MAPT P10636 2/20 0.55
▸ TACR2 P21452 4/20 0.53
▸ SRC P12931 9/20 0.51
▸ HTR2A P28223 2/20 0.47
▸ HTR2C P28335 1/20 0.47
▸ ABL1 P00519 1/20 0.47
▸ EGFR P00533 1/20 0.47
▸ ERBB2 P04626 1/20 0.47
▸ MET P08581 1/20 0.47
▸ PDGFRB P09619 1/20 0.47
▸ KIT P10721 1/20 0.47
▸ FGFR1 P11362 1/20 0.47
▸ FLT1 P17948 1/20 0.47
▸ FGFR2 P21802 1/20 0.47

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
SCHEMBL27430034 0.87 HTR2C (0.48) LMNACYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL27429987 0.77 MAPT (0.48) LMNASMN1; SMN2MAPTSRCHTR2A
SCHEMBL3645171 0.77 HTR2C (0.58) MAPTHTR2AHTR2C
SCHEMBL27430032 0.76 HTR2C (0.60) TACR2SRCHTR2AHTR2C
SCHEMBL27429988 0.76 HTR2C (0.61) HTR2AHTR2C
SCHEMBL27248311 0.75 HPGD (0.58) MAPTHTR2AHTR2CABL1
SCHEMBL11812589 0.75 LMNA (0.94) LMNACYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL23867520 0.74 TDP1 (0.48) SMN1; SMN2MAPT
SCHEMBL27248309 0.74 SRC (0.52) LMNATACR2SRCHTR2AHTR2C
SCHEMBL27248330 0.74 L3MBTL1 (0.58) LMNASMN1; SMN2MAPTSRCHTR2A

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
WO-2024118607-A1 COMPOUNDS, COMPOSITIONS, AND METHODS CHDI FOUNDATION, INC. (US) 2024-06-06 — — WO disclosed
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