SCHEMBL29944002

SCHEMBL29944002

CCOc1cccc(C(=O)N2CCCCC2)c1

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.73
SMN1; SMN2 Q16637 6/20 0.73
NPC1 O15118 5/20 0.73
ALDH1A1 P00352 5/20 0.73
KMT2A Q03164 4/20 0.73
MEN1 O00255 3/20 0.73
TP53 P04637 3/20 0.70
RECQL P46063 1/20 0.70
HPGD P15428 7/20 0.69
L3MBTL1 Q9Y468 2/20 0.67
KDM4E B2RXH2 1/20 0.67
HTT P42858 2/20 0.66
GAA P10253 2/20 0.66
HSD17B10 Q99714 1/20 0.61
LMNA P02545 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
TSHR P16473 2/20 0.54
POLB P06746 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
SCHEMBL9495990 0.85 MEN1 (0.59) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL7864765 0.84 MEN1 (0.60) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL3455335 0.84 RAB9A (1.00) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL9495976 0.84 RAB9A (0.55) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL2534098 0.84 L3MBTL1 (0.74) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL7873479 0.83 MEN1 (0.59) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL8800416 0.82 MEN1 (0.58) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL2536884 0.82 L3MBTL1 (0.76) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL24627425 0.82 MEN1 (0.60) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A
SCHEMBL18611678 0.81 MGLL (0.59) RAB9ASMN1; SMN2NPC1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230110003-A1 PIPERIDINE DERIVATIVES AND COMPOSITIONS FOR THE INHIBITION OF NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE (NAMPT) Valo Health, LLC 2023-04-13 US disclosed
US-11479564-B2 Piperidine derivatives and compositions for the inhibition of nicotinamide phosphoribosyltransferase (NAMPT) VALO HEALTH, INC. (US) 2022-10-25 US 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 (2 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-20230110003-A1 PIPERIDINE DERIVATIVES AND COMPOSITIONS FOR THE INHIBITION OF NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE (NAMPT) NAMPT, NAPRT, NNMT RAB9A 2108/4885SMN1; SMN2 2010/4885NPC1 322/4885
US-11479564-B2 Piperidine derivatives and compositions for the inhibition of nicotinamide phosphoribosyltransferase (NAMPT) NAMPT, NAPRT, NNMT RAB9A 2108/4885SMN1; SMN2 2010/4885NPC1 322/4885

“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.