SCHEMBL21903812

SCHEMBL21903812

COc1ccc(CNc2nccc3c2c(-c2ccc(Oc4ccccc4)cc2)nn3C2CC3CC2N(C(=O)OC(C)(C)C)C3)c(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 7/20 0.41
▸ CYP1A2 P05177 9/20 0.36
▸ CYP3A4 P08684 9/20 0.36
▸ CYP2C19 P33261 9/20 0.36
▸ TSHR P16473 8/20 0.36
▸ ALDH1A1 P00352 5/20 0.36
▸ USP2 O75604 3/20 0.36
▸ CYP2C9 P11712 6/20 0.36
▸ HSD17B10 Q99714 3/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ HIF1A Q16665 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ CYP2D6 P10635 6/20 0.36
▸ CLK4 Q9HAZ1 4/20 0.36
▸ LMNA P02545 3/20 0.36
▸ GPR119 Q8TDV5 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ MEN1 O00255 2/20 0.35

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
SCHEMBL22008946 0.95 BTK (0.40) BTKGPR119
SCHEMBL21903726 0.89 BTK (0.38) BTKCYP1A2CYP3A4CYP2C19TSHR
SCHEMBL21903821 0.87 GPR119 (0.37) CYP1A2CYP3A4CYP2C19TSHRALDH1A1
SCHEMBL22008945 0.86 GPR119 (0.33) BTKCYP1A2CYP3A4CYP2C19TSHR
SCHEMBL21965241 0.85 BTK (0.36) BTKCYP1A2CYP3A4CYP2C19TSHR
SCHEMBL21965766 0.85 BTK (0.49) BTK
SCHEMBL21903689 0.85 BTK (0.49) BTK
SCHEMBL31684271 0.85 BTK (0.49) BTK
SCHEMBL21903643 0.85 BTK (0.46) BTKMAPT
SCHEMBL22902475 0.82 CYP1A2 (0.40) BTKCYP1A2CYP3A4CYP2C19TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3653626-B1 NOVEL 1H-PYRAZOLOPYRIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME DAEWOONG PHARMACEUTICAL CO LTD (KR) 2025-09-17 — — EP disclosed
US-11180496-B2 1H-pyrazolopyridine derivative and pharmaceutical composition comprising the same DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2021-11-23 — — US disclosed
US-11180496-B2 1H-pyrazolopyridine derivative and pharmaceutical composition comprising the same DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2021-11-23 — — US disclosed
EP-3653626-A1 NOVEL 1H-PYRAZOLOPYRIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Daewoong Pharmaceutical Co., Ltd. (KR) 2020-05-20 — — EP disclosed
US-20200140432-A1 NOVEL 1H-PYRAZOLOPYRIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2020-05-07 — — US disclosed
US-20200140432-A1 NOVEL 1H-PYRAZOLOPYRIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2020-05-07 — — 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-11180496-B2 1H-pyrazolopyridine derivative and pharmaceutical composition comprising the same PDCD11, DPYD, G6PC1 BTK 1236/4885CYP1A2 404/4885CYP3A4 255/4885
US-20200140432-A1 NOVEL 1H-PYRAZOLOPYRIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME PDCD11, G6PC1, PPM1D BTK 1744/4885CYP1A2 722/4885CYP3A4 408/4885

“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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