SCHEMBL4679769

SCHEMBL4679769

O=C(Cc1cccs1)NCC1CC1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.67
HSD17B10 Q99714 1/20 0.67
HPGD P15428 6/20 0.64
ALDH1A1 P00352 2/20 0.64
RAB9A P51151 2/20 0.57
KMT2A Q03164 5/20 0.56
MEN1 O00255 3/20 0.56
GAA P10253 1/20 0.56
GFER P55789 1/20 0.56
KDM4E B2RXH2 1/20 0.56
PKM P14618 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.54
NPC1 O15118 1/20 0.52
TSHR P16473 1/20 0.52

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
SCHEMBL1328153 0.82 POLB (0.49) POLBHSD17B10HPGDALDH1A1RAB9A
SCHEMBL15033485 0.80 POLB (1.00) POLBHSD17B10HPGDALDH1A1KMT2A
SCHEMBL2309785 0.79 HPGD (0.49) POLBHSD17B10HPGDALDH1A1RAB9A
SCHEMBL2305785 0.79 POLB (0.49) POLBHSD17B10HPGDALDH1A1RAB9A
SCHEMBL11704529 0.78 HPGD (0.74) POLBHPGDALDH1A1RAB9AKMT2A
SCHEMBL8319802 0.77 HPGD (0.72) POLBHSD17B10HPGDALDH1A1RAB9A
SCHEMBL11077045 0.76 HPGD (0.70) POLBHPGDALDH1A1RAB9AKMT2A
SCHEMBL11627330 0.76 HPGD (0.70) POLBHPGDALDH1A1RAB9AKMT2A
SCHEMBL10546402 0.76 HPGD (0.70) POLBHPGDALDH1A1RAB9AKMT2A
SCHEMBL6076695 0.75 KMT2A (0.66) POLBHSD17B10HPGDALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1416933-B1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM INC (US) 2008-01-02 EP claimed
US-6977264-B2 Substituted piperidines and methods of use AMGEN INC. (US) 2005-12-20 US claimed
US-20040006067-A1 Substituted piperidines and methods of use AMGEN INC. 2004-01-08 US claimed
EP-1416933-B8 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEN INC (US) 2008-08-27 EP disclosed
US-6977264-B2 Substituted piperidines and methods of use AMGEN INC. (US) 2005-12-20 US disclosed
EP-1416933-A1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR Amgem, Inc. (US) 2004-05-12 EP disclosed
US-20040006067-A1 Substituted piperidines and methods of use AMGEN INC. 2004-01-08 US disclosed
WO-2003009847-A1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM, INC. (US) 2003-02-06 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-20040006067-A1 Substituted piperidines and methods of use MC4R, MC5R, MC1R POLB 1584/4885HSD17B10 2357/4885HPGD 608/4885

“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.