SCHEMBL19030182

SCHEMBL19030182

CC1(C2CC2)Cc2ccc(Cl)cc2O1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAP3K14 Q99558 3/20 0.41
▸ SRD5A1 P18405 6/20 0.36
▸ HTR2C P28335 3/20 0.35
▸ AHR P35869 1/20 0.34
▸ HTR2A P28223 1/20 0.34
▸ AKR1B1 P15121 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
SCHEMBL19030789 0.80 HIF1A (0.36) SRD5A1HTR2CHTR2AAKR1B1
SCHEMBL19029897 0.79 MAOB (0.39) MAP3K14HTR2CAHRHTR2A
SCHEMBL19030772 0.73 MAP3K14 (0.43) MAP3K14HTR2CAHRHTR2AAKR1B1
SCHEMBL19030561 0.72 PDK2 (0.38) MAP3K14HTR2CAHRHTR2A
SCHEMBL19030687 0.71 AKR1B1 (0.41) AKR1B1
SCHEMBL19030472 0.71 AKR1B1 (0.42) AKR1B1
SCHEMBL19030554 0.71 MAP3K14 (0.33) MAP3K14HTR2CAHRHTR2A
SCHEMBL23422992 0.69 KDM1A (0.40) MAP3K14SRD5A1HTR2CAHRHTR2A
SCHEMBL10192235 0.68 KDM4E (0.41) MAP3K14HTR2CAHR
SCHEMBL10192220 0.68 KDM4E (0.41) MAP3K14HTR2CAHR

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
US-20220332718-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS GENENTECH, INC. (US) 2022-10-20 — — US disclosed
CN-108473498-B Pyrazolo [1,5a ] pyrimidine derivatives as IRAK4 modulators 豪夫迈·罗氏有限公司 2021-11-02 — — CN disclosed
US-10988478-B1 Pyrazolo[1,5a]pyrimidine derivatives as IRAK4 modulators GENENTECH, INC. (US) 2021-04-27 — — US disclosed
US-10988478-B1 Pyrazolo[1,5a]pyrimidine derivatives as IRAK4 modulators GENENTECH, INC. (US) 2021-04-27 — — US disclosed
EP-3394066-A2 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS H. Hoffnabb-La Roche Ag (CH) 2018-10-31 — — EP disclosed
US-20180298015-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS GENENTECH, INC. (US) 2018-10-18 — — US disclosed
WO-2017108723-A2 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2017-06-29 — — WO disclosed
WO-2017108723-A2 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2017-06-29 — — 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 (3 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-20180298015-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS IRAK1, IRAK4, IRAK2 MAP3K14 43/4885SRD5A1 1582/4885HTR2C 2411/4885
US-20220332718-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS IRAK1, IRAK4, IRAK2 MAP3K14 46/4885SRD5A1 1193/4885HTR2C 2980/4885
US-10988478-B1 Pyrazolo[1,5a]pyrimidine derivatives as IRAK4 modulators IRAK1, IRAK4, IRAK2 MAP3K14 43/4885SRD5A1 1582/4885HTR2C 2411/4885

“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.

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