SCHEMBL2854624

SCHEMBL2854624

COc1ccc(-n2cc(C(=O)O)cn2)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 4/20 0.67
HPGDS O60760 1/20 0.66
ALKBH2 Q6NS38 1/20 0.66
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
RAB9A P51151 2/20 0.64
MAPT P10636 2/20 0.64
KDM4E B2RXH2 1/20 0.64
NPC1 O15118 1/20 0.64
ALDH1A1 P00352 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
MAPKAPK2 P49137 1/20 0.63
ALKBH1 Q13686 3/20 0.61
GAA P10253 1/20 0.57
PTGDR2 Q9Y5Y4 2/20 0.54
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53

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
SCHEMBL182164 0.87 MAPKAPK2 (0.79) EGLN1HPGDSALKBH2MEN1KMT2A
SCHEMBL10998710 0.84 EGLN1 (0.66) EGLN1HPGDSALKBH2MEN1KMT2A
SCHEMBL2852078 0.82 ALKBH2 (0.72) EGLN1HPGDSALKBH2RAB9AMAPT
SCHEMBL9034514 0.81 MEN1 (0.57) EGLN1MEN1KMT2ARAB9AMAPT
SCHEMBL1330707 0.81 XDH (0.58) EGLN1
SCHEMBL15331859 0.81 ALKBH2 (0.70) EGLN1HPGDSALKBH2RAB9AMAPT
SCHEMBL15578982 0.81 HPGDS (0.60) EGLN1HPGDSALKBH2ALKBH1
SCHEMBL14150633 0.81 ALKBH1 (0.63) EGLN1HPGDSALKBH2ALKBH1
SCHEMBL182309 0.80 MAPKAPK2 (0.61) EGLN1MEN1KMT2ARAB9AMAPT
SCHEMBL70281 0.80 ALKBH2 (1.00) EGLN1HPGDSALKBH2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed
US-11136297-B2 Compositions and methods for treating cancer THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-10-05 US disclosed
US-20200131135-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-04-30 US disclosed
EP-2895477-B1 PYRAZOLE CARBOXAMIDE DERIVATIVES AS TAAR MODULATORS FOR USE IN THE TREATMENT OF SEVERAL DISORDERS, SUCH AS DEPRESSION, DIABETES AND PARKINSON'S DISEASE. HOFFMANN LA ROCHE (CH) 2017-11-01 EP disclosed
US-9487501-B2 Pyrazole carboxamide compounds and uses thereof HOFFMANN-LA ROCHE INC. (US) 2016-11-08 US disclosed
US-20150218131-A1 PYRAZOLE CARBOXAMIDE COMPOUNDS AND USES THEREOF HOFFMANN-LA ROCHE INC. (US) 2015-08-06 US disclosed
EP-2895477-A1 PYRAZOLE CARBOXAMIDE DERIVATIVES AS TAAR MODULATORS FOR USE IN THE TREATMENT OF SEVERAL DISORDERS, SUCH AS DEPRESSION, DIABETES AND PARKINSON'S DISEASE F. Hoffmann-La Roche AG (CH) 2015-07-22 EP disclosed
WO-2014041007-A1 PYRAZOLE CARBOXAMIDE DERIVATIVES AS TAAR MODULATORS FOR USE IN THE TREATMENT OF SEVERAL DISORDERS, SUCH AS DEPRESSION, DIABETES AND PARKINSON'S DISEASE F. HOFFMANN-LA ROCHE AG (CH) 2014-03-20 WO disclosed
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP disclosed
US-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES ICAGEN, INC. (US) 2008-03-13 US disclosed
US-7223782-B2 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2007-05-29 US disclosed
US-20050049237-A1 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2005-03-03 US disclosed
EP-0540614-B1 3-(1-SUBSTITUTEDPYRAZOYL)-2-OXINDOLE DERIVATIVES PFIZER (US) 1996-08-21 EP disclosed
EP-0540614-A1 3-(1-SUBSTITUTEDPYRAZOYL)-2-OXINDOLE DERIVATIVES. PFIZER (US) 1993-05-12 EP disclosed
WO-1992001684-A1 3-(1-SUBSTITUTEDPYRAZOYL)-2-OXINDOLE DERIVATIVES PFIZER INC. (US) 1992-02-06 WO disclosed
US-5064851-A Enzyme inhibitors, antiinflammatory PFIZER INC. (US) 1991-11-12 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 (5 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-20200131135-A1 COMPOSITIONS AND METHODS FOR TREATING CANCER HRAS, KRAS, NRAS EGLN1 833/4885HPGDS 484/4885ALKBH2 1022/4885
US-11136297-B2 Compositions and methods for treating cancer HRAS, KRAS, NRAS EGLN1 833/4885HPGDS 484/4885ALKBH2 1022/4885
US-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES SCN3A, TRPV3, HCN3 EGLN1 2638/4885HPGDS 1109/4885ALKBH2 4440/4885
US-20050049237-A1 Pyrazole-amides and -sulfonamides SCN3A, TRPV3, HCN3 EGLN1 2638/4885HPGDS 1109/4885ALKBH2 4440/4885
US-20150218131-A1 PYRAZOLE CARBOXAMIDE COMPOUNDS AND USES THEREOF HCRTR1, TAAR1, HCRTR2 EGLN1 2787/4885HPGDS 3652/4885ALKBH2 1243/4885

“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.