SCHEMBL31744299

SCHEMBL31744299

CC(C)(C)OC(=O)N1CCN(c2ccc(-c3ccc(NC(=O)NCc4ccn5ccnc5c4)cc3C#Cc3ccc(F)cc3)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 4/20 0.38
▸ WNT3A P56704 2/20 0.38
▸ ALK Q9UM73 1/20 0.38
▸ SMN1; SMN2 Q16637 5/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ MAPT P10636 3/20 0.37
▸ HTT P42858 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ LMNA P02545 2/20 0.37
▸ RET P07949 1/20 0.36
▸ GRIA1 P42261 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ EGLN2 Q96KS0 1/20 0.36
▸ SQOR Q9Y6N5 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ NPC1 O15118 1/20 0.35

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
SCHEMBL31744295 0.87 NAMPT (0.40) NAMPTALKMAPT
SCHEMBL31744301 0.83 NAMPT (0.47) NAMPTWNT3ARET
SCHEMBL31744290 0.82 NAMPT (0.45) NAMPT
SCHEMBL31037296 0.81 ALK (0.41) NAMPTWNT3AALKSMN1; SMN2MEN1
SCHEMBL31744278 0.77 MTOR (0.40) NAMPTALKSMN1; SMN2MEN1KMT2A
SCHEMBL31037501 0.76 GRM2 (0.37) NAMPTNPSR1LMNAALDH1A1
SCHEMBL31037284 0.76 NAMPT (0.47) NAMPTSMN1; SMN2KMT2AALDH1A1NPC1
SCHEMBL31037342 0.75 NAMPT (0.39) NAMPTMEN1KMT2AMAPT
SCHEMBL15376674 0.73 NAMPT (0.53) NAMPTWNT3A
SCHEMBL31744308 0.72 NAMPT (0.43) NAMPTMEN1KMT2AMAPT

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-4663628-A1 NEW COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Samjin Pharmaceutical Co., Ltd. (KR) 2025-12-17 — — EP disclosed
Send feedback