SCHEMBL23747385

SCHEMBL23747385

COc1ccc(CNC(=O)Nc2ccc([C@H](C)N)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.70
RAB9A P51151 5/20 0.67
NPC1 O15118 5/20 0.67
HDAC1 Q13547 1/20 0.64
HDAC6 Q9UBN7 1/20 0.64
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
HTT P42858 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.61
POLB P06746 1/20 0.61
ROCK2 O75116 1/20 0.58
NAMPT P43490 3/20 0.57
SAE1 Q9UBE0 1/20 0.56
UBA2 Q9UBT2 1/20 0.56
HIF1A Q16665 1/20 0.54
ALDH1A1 P00352 1/20 0.54
EPHX2 P34913 1/20 0.54

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
Hydrochloric Acid SCHEMBL23728254 0.99 SMN1; SMN2 (0.68) SMN1; SMN2RAB9ANPC1HDAC1HDAC6
SCHEMBL17916794 0.88 SMN1; SMN2 (0.88) SMN1; SMN2RAB9ANPC1HDAC1HDAC6
SCHEMBL28945412 0.85 SMN1; SMN2 (0.64) SMN1; SMN2RAB9ANPC1HDAC1HDAC6
SCHEMBL28945410 0.85 SMN1; SMN2 (0.64) SMN1; SMN2RAB9ANPC1HDAC1HDAC6
SCHEMBL23747660 0.85 SMN1; SMN2 (0.67) SMN1; SMN2RAB9ANPC1HDAC1HDAC6
SCHEMBL23747521 0.85 SMN1; SMN2 (0.67) SMN1; SMN2RAB9ANPC1HDAC1HDAC6
SCHEMBL23747599 0.84 RAB9A (0.68) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL23728196 0.84 RAB9A (0.68) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL23727729 0.84 SMN1; SMN2 (0.69) SMN1; SMN2RAB9ANPC1HDAC1HDAC6
SCHEMBL23728118 0.84 SMN1; SMN2 (0.77) SMN1; SMN2RAB9ANPC1HDAC1HDAC6

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
US-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 US disclosed
US-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 US disclosed
WO-2021159015-A1 NAMPT MODULATORS CYTOKINETICS, INC. (US) 2021-08-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230133132-A1 NAMPT MODULATORS NAMPT, MC4R, SIRT1 SMN1; SMN2 1161/4885RAB9A 807/4885NPC1 463/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.