SCHEMBL23747812

SCHEMBL23747812

O=C(NCc1ccc(F)cc1)Nc1ccc(CC(=O)N2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.53
POLB P06746 2/20 0.53
NPC1 O15118 2/20 0.52
MAOB P27338 1/20 0.52
ALDH1A1 P00352 1/20 0.51
NAMPT P43490 6/20 0.48
KMT2A Q03164 3/20 0.47
RORC P51449 1/20 0.43
MEN1 O00255 2/20 0.42
MAPT P10636 1/20 0.42
CYP3A4 P08684 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL23747810 1.00 RAB9A (0.53) RAB9APOLBNPC1MAOBALDH1A1
SCHEMBL26100411 1.00 RAB9A (0.53) RAB9APOLBNPC1MAOBALDH1A1
SCHEMBL26102225 0.89 RAB9A (0.53) RAB9APOLBNPC1NAMPTKMT2A
SCHEMBL26547014 0.89 RAB9A (0.53) RAB9APOLBNPC1NAMPTKMT2A
SCHEMBL26547010 0.89 RAB9A (0.53) RAB9APOLBNPC1NAMPTKMT2A
SCHEMBL23747772 0.89 RAB9A (0.55) RAB9APOLBNPC1MAOBALDH1A1
SCHEMBL30361379 0.88 RAB9A (0.54) RAB9APOLBNPC1MAOBALDH1A1
SCHEMBL26547117 0.88 RAB9A (0.54) RAB9APOLBNPC1MAOBALDH1A1
SCHEMBL26102371 0.86 RAB9A (0.57) RAB9APOLBNPC1MAOBALDH1A1
SCHEMBL23747816 0.86 SMN1; SMN2 (0.57) RAB9APOLBNPC1ALDH1A1NAMPT

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 RAB9A 807/4885POLB 4018/4885NPC1 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.