SCHEMBL612950

SCHEMBL612950

Cc1cc(F)ccc1N1CCC[C@H](C(=O)NC2CCCCC2)C1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.60
HSD17B10 Q99714 2/20 0.60
TSHR P16473 2/20 0.60
EPHX2 P34913 7/20 0.60
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 1/20 0.53
RAB9A P51151 2/20 0.52
MAPK1 P28482 1/20 0.50
MAPT P10636 1/20 0.48
ALDH1A1 P00352 1/20 0.48
ACKR3 P25106 1/20 0.47

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
SCHEMBL612909 0.84 TSHR (0.57) GAAHSD17B10TSHREPHX2RAB9A
SCHEMBL4963043 0.84 TSHR (0.57) GAAHSD17B10TSHREPHX2RAB9A
SCHEMBL27665046 0.84 GAA (0.52) GAAHSD17B10TSHREPHX2KMT2A
SCHEMBL613012 0.84 TSHR (0.59) GAAHSD17B10TSHREPHX2KMT2A
SCHEMBL613325 0.80 EPHX2 (0.81) TSHREPHX2KMT2ARAB9AALDH1A1
SCHEMBL612539 0.79 EPHX2 (0.57) GAAHSD17B10TSHREPHX2KMT2A
SCHEMBL5247365 0.78 EPHX2 (0.79) TSHREPHX2KMT2ARAB9AALDH1A1
SCHEMBL20942590 0.77 NPC1 (0.51) TSHRKMT2ARAB9A
SCHEMBL4005128 0.77 EPHX2 (0.79) TSHREPHX2KMT2ARAB9A
SCHEMBL4005134 0.77 EPHX2 (0.79) TSHREPHX2KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8071624-B2 N-substituted piperidines and their use as pharmaceuticals INCYTE CORPORATION (US) 2011-12-06 US claimed
US-20060004049-A1 N-substituted piperidines and their use as pharrmaceuticals INCYTE CORPORATION 2006-01-05 US claimed
US-8288417-B2 N-substituted piperidines and their use as pharmaceuticals INCYTE CORPORATION (US) 2012-10-16 US disclosed
US-8288417-B2 N-substituted piperidines and their use as pharmaceuticals INCYTE CORPORATION (US) 2012-10-16 US disclosed
US-8288417-B2 N-substituted piperidines and their use as pharmaceuticals INCYTE CORPORATION (US) 2012-10-16 US disclosed
US-20120040964-A1 N-SUBSTITUTED PIPERIDINES AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-02-16 US disclosed
US-20120040964-A1 N-SUBSTITUTED PIPERIDINES AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-02-16 US disclosed
US-20120040964-A1 N-SUBSTITUTED PIPERIDINES AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2012-02-16 US disclosed
US-8071624-B2 N-substituted piperidines and their use as pharmaceuticals INCYTE CORPORATION (US) 2011-12-06 US disclosed
US-8071624-B2 N-substituted piperidines and their use as pharmaceuticals INCYTE CORPORATION (US) 2011-12-06 US disclosed
US-8071624-B2 N-substituted piperidines and their use as pharmaceuticals INCYTE CORPORATION (US) 2011-12-06 US disclosed
US-20060004049-A1 N-substituted piperidines and their use as pharrmaceuticals INCYTE CORPORATION 2006-01-05 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-20120040964-A1 N-SUBSTITUTED PIPERIDINES AND THEIR USE AS PHARMACEUTICALS HSD11B1, CYP11B1, HSD3B1 GAA 951/4885HSD17B10 49/4885TSHR 1143/4885
US-20060004049-A1 N-substituted piperidines and their use as pharrmaceuticals HSD11B1, HSD3B1, HSD11B2 GAA 518/4885HSD17B10 41/4885TSHR 1444/4885

“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.