SCHEMBL27967273

SCHEMBL27967273

CNC(=O)c1c(NC)ncn1CC1OCCO1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.42
▸ YTHDC1 Q96MU7 5/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ PDE10A Q9Y233 2/20 0.32
▸ P2RY1 P47900 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ IKBKB O14920 1/20 0.30
▸ CHUK O15111 1/20 0.30
▸ AURKA O14965 1/20 0.30
▸ RET P07949 1/20 0.30
▸ SRC P12931 1/20 0.30
▸ AXL P30530 1/20 0.30
▸ KDR P35968 1/20 0.30
▸ FLT3 P36888 1/20 0.30
▸ MERTK Q12866 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
SCHEMBL19036600 0.78 YTHDC1 (0.37) YTHDC1P2RY1IKBKBCHUK
SCHEMBL28708198 0.78 KMT2A (0.40) KMT2ACNR1CNR2
SCHEMBL9010469 0.76 IKBKB (0.36) YTHDC1P2RY1IKBKBCHUK
SCHEMBL18175167 0.76 LMNA (0.37) YTHDC1PDE10AP2RY1IKBKBCHUK
SCHEMBL10280149 0.74 TRPA1 (0.36) YTHDC1P2RY1IKBKBCHUK
SCHEMBL19036512 0.72 P2RY1 (0.37) YTHDC1P2RY1IKBKBCHUK
SCHEMBL20079775 0.72 PTGS2 (0.43) KMT2A
SCHEMBL29188197 0.71 POLB (0.41) P2RY1
SCHEMBL10394052 0.71 HDAC1 (0.39) KMT2AYTHDC1CNR1
SCHEMBL20079665 0.65 HDAC1 (0.48) YTHDC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103837612-A Method for measuring related substances of doxofylline injection HEILONGJIANG FUHE HUAXING PHARMACEUTICAL GROUP CO LTD 2014-06-04 — — CN claimed
CN-119909028-A Doxofylline tablet and preparation method thereof 福安药业集团宁波天衡制药有限公司 2025-05-02 — — CN disclosed
CN-103837612-A Method for measuring related substances of doxofylline injection HEILONGJIANG FUHE HUAXING PHARMACEUTICAL GROUP CO LTD 2014-06-04 — — CN disclosed
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