SCHEMBL2471448

SCHEMBL2471448

O=C(O)c1cccnc1CC1CCCO1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
POLB P06746 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
HCAR3 P49019 1/20 0.46
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 3/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.43
NPC1 O15118 2/20 0.42
PKM P14618 2/20 0.42
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
AURKA O14965 1/20 0.41
RPS6KB1 P23443 1/20 0.41
ALOX15 P16050 2/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
BLM P54132 1/20 0.41

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
SCHEMBL2751452 0.96 MAPT (0.43) MAPTPOLBL3MBTL1HCAR3KDM4E
SCHEMBL2751335 0.77 KDM5B (0.49) MAPTPOLBL3MBTL1KDM4EALDH1A1
SCHEMBL18280144 0.74 HPGD (0.47) ALDH1A1HPGDPKMCYP3A4
SCHEMBL30969102 0.74 MAPT (0.47) MAPTPOLBKDM4EALDH1A1HPGD
SCHEMBL2471450 0.73 HCAR3 (0.43) MAPTPOLBHCAR3KDM4EHPGD
SCHEMBL28573810 0.73 KDM4E (0.45) MAPTL3MBTL1KDM4EALDH1A1GAA
SCHEMBL28323432 0.73 HPGD (0.63) MAPTPOLBL3MBTL1KDM4EALDH1A1
Hydrochloric Acid SCHEMBL2472732 0.72 KDM4C (0.43) MAPTPOLBHCAR3KDM4EHPGD
SCHEMBL3675628 0.72 POLB (0.46) MAPTPOLBL3MBTL1KDM4EALDH1A1
SCHEMBL2278307 0.71 KMT2A (0.48) MAPTKDM4EALDH1A1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2370177-B1 NOVEL COSMETIC COMPOSITIONS HAVING HAIR GROWTH INHIBITING EFFECT HENKEL AG & CO KGAA (DE) 2017-11-15 EP claimed
EP-1949887-A2 Cosmetic formulas for skin smoothing and tautening Henkel AG & Co. KGaA (DE) 2008-07-30 EP claimed
EP-1938789-A1 Improvement of the skin friendliness of hyperemizing agents Henkel AG & Co. KGaA (DE) 2008-07-02 EP claimed
EP-2370177-B1 NOVEL COSMETIC COMPOSITIONS HAVING HAIR GROWTH INHIBITING EFFECT HENKEL AG & CO KGAA (DE) 2017-11-15 EP disclosed
EP-2370177-A2 NOVEL COSMETIC COMPOSITIONS HAVING HAIR GROWTH INHIBITING EFFECT Henkel AG & Co. KGaA (DE) 2011-10-05 EP disclosed
EP-2238964-A2 Stabilised cosmetic compounds Henkel AG & Co. KGaA (DE) 2010-10-13 EP disclosed
US-20100227896-A1 USE OF VITAMIN PP COMPOUNDS ASTELLAS DEUTSCHLAND GMBH (DE) 2010-09-09 US disclosed
WO-2010063673-A2 NOVEL COSMETIC COMPOSITIONS HAVING HAIR GROWTH INHIBITING EFFECT HENKEL AG & CO. KGAA (DE) 2010-06-10 WO disclosed
EP-1949887-A2 Cosmetic formulas for skin smoothing and tautening Henkel AG & Co. KGaA (DE) 2008-07-30 EP disclosed
EP-1938789-A1 Improvement of the skin friendliness of hyperemizing agents Henkel AG & Co. KGaA (DE) 2008-07-02 EP disclosed
EP-1079832-B1 USE OF VITAMIN PP COMPOUNDS KLINGE CO CHEM PHARM FAB (DE) 2005-11-30 EP disclosed
EP-1079832-A1 USE OF VITAMIN PP COMPOUNDS Klinge Pharma GmbH (DE) 2001-03-07 EP disclosed
WO-1999053920-A1 USE OF VITAMIN PP COMPOUNDS KLINGE PHARMA GMBH (DE) 1999-10-28 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-20100227896-A1 USE OF VITAMIN PP COMPOUNDS PNPO, NAMPT, NAPRT MAPT 2497/4885POLB 1119/4885L3MBTL1 4790/4885

“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.