SCHEMBL28595299

SCHEMBL28595299

N#CC1(c2ccc(Cl)nc2)CCCC1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.48
OPRM1 P35372 4/20 0.41
ALDH1A1 P00352 3/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TNF P01375 1/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
LMNA P02545 2/20 0.35
TP53 P04637 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
POLB P06746 1/20 0.33

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
SCHEMBL15821832 0.98 MAP4K4 (0.47) MAP4K4OPRM1ALDH1A1NPC1RAB9A
SCHEMBL876741 0.97 MAP4K4 (0.45) MAP4K4OPRM1ALDH1A1NPC1RAB9A
SCHEMBL29574467 0.93 OPRM1 (0.42) MAP4K4OPRM1TNF
SCHEMBL350982 0.93 OPRM1 (0.42) MAP4K4OPRM1TNF
SCHEMBL15129658 0.85 OPRM1 (0.38) MAP4K4OPRM1TNFSLC6A4SLC6A3
SCHEMBL5309575 0.85 OPRM1 (0.38) MAP4K4OPRM1TNF
SCHEMBL15129340 0.84 PDE4A (0.41) MAP4K4OPRM1NPC1RAB9AMEN1
SCHEMBL31014508 0.81 OPRM1 (0.33) MAP4K4OPRM1NPC1RAB9ATNF
SCHEMBL1141603 0.79 MAP4K4 (0.45) MAP4K4OPRM1ALDH1A1NPC1RAB9A
SCHEMBL25512254 0.79 MAP4K4 (0.42) MAP4K4OPRM1ALDH1A1NPC1RAB9A

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
WO-2026090477-A1 HELICASE INHIBITORS AND USES THEREOF KIMIA THERAPEUTICS, INC. (US) 2026-04-30 WO disclosed
CN-113061098-B Amide compound and derivative thereof, preparation method, pharmaceutical composition and application 中国药科大学 2022-08-30 CN disclosed
CN-113061098-A Amide compound and derivative thereof, preparation method, pharmaceutical composition and application 中国药科大学 2021-07-02 CN disclosed