SCHEMBL17783261

SCHEMBL17783261

COc1cc2c(cc1CC(C)C)-c1c(c(C(=O)NCC(C)(C)C)nn1-c1cccs1)CO2

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 2/20 0.31
▸ MAPT P10636 4/20 0.31
▸ TSHR P16473 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 3/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ GAA P10253 1/20 0.30
▸ NR1H4 Q96RI1 1/20 0.30
▸ PDE4D Q08499 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ HCRTR1 O43613 1/20 0.30
▸ HCRTR2 O43614 1/20 0.30
▸ HPGD P15428 2/20 0.30

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
SCHEMBL16340567 0.88 NR1H4 (0.33) MAPTALOX5KMT2AMEN1ALDH1A1
SCHEMBL17783251 0.87 RORC (0.31) RORCMAPTALDH1A1NPC1RAB9A
SCHEMBL16377728 0.86 NR1H4 (0.33) NR1H4
SCHEMBL17783239 0.85 KMT2A (0.32) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL16377990 0.85 KCNK3 (0.39) MAPTTSHRKMT2AMEN1ALDH1A1
SCHEMBL16377945 0.77 RAD52 (0.35) RORCMAPTNR1H4TP53
SCHEMBL17783237 0.76 KMT2A (0.32) MAPTKMT2AALDH1A1NPC1RAB9A
SCHEMBL16377946 0.76 CNR2 (0.36) PDE4D
SCHEMBL16377983 0.75 RAD52 (0.34) RORCMAPTNR1H4PDE4DTP53
SCHEMBL16334004 0.75 CNR2 (0.33) MAPTKMT2ANR1H4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11365199-B2 Pyrazole compounds as modulators of FSHR and uses thereof MERCK PATENT GMBH (DE) 2022-06-21 — — US disclosed
EP-3013832-B1 PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF MERCK PATENT GMBH (DE) 2020-11-04 — — EP disclosed
US-20180354965-A1 PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF MERCK PATENT GMBH (DE) 2018-12-13 — — US disclosed
US-10081637-B2 Pyrazole compounds as modulators of FSHR and uses thereof MERCK PATENT GMBH (DE) 2018-09-25 — — US disclosed
US-20160152626-A1 PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF MERCK PATENT GMBH (DE) 2016-06-02 — — 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 (4 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-11365199-B2 Pyrazole compounds as modulators of FSHR and uses thereof FSHR, GNRHR, LHCGR RORC 216/4885MAPT 4321/4885TSHR 10/4885
US-10081637-B2 Pyrazole compounds as modulators of FSHR and uses thereof FSHR, GNRHR, LHCGR RORC 216/4885MAPT 4321/4885TSHR 10/4885
US-20160152626-A1 PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF FSHR, GNRHR, LHCGR RORC 216/4885MAPT 4321/4885TSHR 10/4885
US-20180354965-A1 PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF FSHR, GNRHR, LHCGR RORC 216/4885MAPT 4321/4885TSHR 10/4885

“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.

Send feedback