SCHEMBL17048919

SCHEMBL17048919

CCOC(=O)[C@]1(C)CC[C@@H](n2ncc(C(=O)O)c2C(F)(F)F)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PRMT1 Q99873 1/20 0.35
KDM4E B2RXH2 7/20 0.35
ALDH1A1 P00352 5/20 0.35
HPGD P15428 5/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
GAA P10253 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TRPC1 P48995 2/20 0.35
TRPC3 Q13507 2/20 0.35
STIM1 Q13586 2/20 0.35
ORAI1 Q96D31 2/20 0.35
STIM2 Q9P246 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL17048921 1.00 MAPT (0.37) MAPTPOLBSMN1; SMN2PRMT1KDM4E
SCHEMBL17098721 1.00 MAPT (0.37) MAPTPOLBSMN1; SMN2PRMT1KDM4E
SCHEMBL17098046 0.91 TRPC1 (0.38) MAPTPOLBSMN1; SMN2PRMT1KDM4E
SCHEMBL17098049 0.91 TRPC1 (0.38) MAPTPOLBSMN1; SMN2PRMT1KDM4E
SCHEMBL17048961 0.88 GAA (0.36) MAPTPOLBSMN1; SMN2KDM4EALDH1A1
SCHEMBL17099050 0.88 GAA (0.36) MAPTPOLBSMN1; SMN2KDM4EALDH1A1
SCHEMBL17099049 0.88 GAA (0.36) MAPTPOLBSMN1; SMN2KDM4EALDH1A1
SCHEMBL17117915 0.86 TRPC1 (0.37) MAPTPOLBSMN1; SMN2KDM4EALDH1A1
SCHEMBL17097834 0.86 KDM4E (0.41) MAPTPOLBKDM4EALDH1A1HPGD
SCHEMBL17110393 0.85 PRMT1 (0.38) MAPTPOLBPRMT1KDM4EALDH1A1

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-3110810-B1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LTD (JP) 2018-05-02 EP disclosed
EP-3110810-A1 PYRAZOLE AMIDE DERIVATIVE Teijin Pharma Limited (JP) 2017-01-04 EP disclosed
US-9365522-B2 Pyrazole amide derivative AMGEN INC. (US) 2016-06-14 US disclosed
US-9365522-B2 Pyrazole amide derivative AMGEN INC. (US) 2016-06-14 US disclosed
US-20150266824-A1 Pyrazole Amide Derivative TEIJIN LIMITED (JP) 2015-09-24 US disclosed
US-20150266824-A1 Pyrazole Amide Derivative TEIJIN LIMITED (JP) 2015-09-24 US disclosed
WO-2015129926-A1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LIMITED (JP) 2015-09-03 WO disclosed
WO-2015129926-A1 PYRAZOLE AMIDE DERIVATIVE TEIJIN PHARMA LIMITED (JP) 2015-09-03 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-20150266824-A1 Pyrazole Amide Derivative RORC, RORB, RORA MAPT 3584/4885POLB 4102/4885SMN1; SMN2 4679/4885

“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.