SCHEMBL19949173

SCHEMBL19949173

CN1CCN(c2ccc(-c3nn(C(=O)O)c4cnc(Cl)nc34)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 5/20 0.46
MAP4K1 Q92918 4/20 0.40
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
F12 P00748 1/20 0.40
NPC1 O15118 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HDAC3 O15379 1/20 0.39
HDAC2 Q92769 1/20 0.39
PIM1 P11309 1/20 0.39
PIM3 Q86V86 1/20 0.39
USP2 O75604 2/20 0.39
CYP1A2 P05177 2/20 0.39
GLA P06280 2/20 0.39
CASP1 P29466 2/20 0.39
CASP7 P55210 2/20 0.39
HIF1A Q16665 2/20 0.39
HSD17B10 Q99714 2/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL19949059 0.88 RAB9A (0.41) RAB9AHDAC3HDAC2FGFR1FGFR2
SCHEMBL19949332 0.86 CHEK1 (0.40) CHEK1ALDH1A1SMN1; SMN2F12PIM1
SCHEMBL19948887 0.86 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2HDAC3HDAC2USP2
SCHEMBL19948961 0.85 PDK1 (0.44) RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL19950082 0.81 CHEK1 (0.45) CHEK1MAP4K1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL19949035 0.77 CNR2 (0.47) ALDH1A1SMN1; SMN2LMNA
SCHEMBL19949226 0.75 PGK1 (0.43) RAB9AFGFR1FGFR2FGFR3BMPR1A
SCHEMBL19948718 0.74 RET (0.40) CHEK1MAP4K1ALDH1A1SMN1; SMN2USP2
SCHEMBL19967588 0.73 RET (0.39) CHEK1MAP4K1ALDH1A1SMN1; SMN2USP2
SCHEMBL19949165 0.73 MAPT (0.40) SMN1; SMN2HDAC3HDAC2

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
US-11542265-B2 Pyrazolopyrimidine compounds and uses thereof INCYTE CORPORATION (US) 2023-01-03 US disclosed
US-20210371425-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2021-12-02 US disclosed
US-11014929-B2 Pyrazolopyrimidine compounds and uses thereof INCYTE CORPORATION (US) 2021-05-25 US disclosed
US-20200172545-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2020-06-04 US disclosed
US-20180072741-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF INCYTE CORPORATION 2018-03-15 US disclosed
WO-2018049152-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS HPK1 MODULATORS AND USES THEREOF FOR THE TREATMENT OF CANCER INCYTE CORPORATION (US) 2018-03-15 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 (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-20200172545-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF PDXK, PCK1, MAPKAPK5 CHEK1 323/4885MAP4K1 32/4885ALDH1A1 1681/4885
US-20180072741-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF PDXK, PCK1, PDK2 CHEK1 221/4885MAP4K1 67/4885ALDH1A1 2137/4885
US-11014929-B2 Pyrazolopyrimidine compounds and uses thereof PDXK, PCK1, MAPKAPK5 CHEK1 323/4885MAP4K1 32/4885ALDH1A1 1681/4885
US-11542265-B2 Pyrazolopyrimidine compounds and uses thereof PDXK, PCK1, PDK2 CHEK1 221/4885MAP4K1 67/4885ALDH1A1 2137/4885
US-20210371425-A1 PYRAZOLOPYRIMIDINE COMPOUNDS AND USES THEREOF PDXK, PCK1, PDK2 CHEK1 221/4885MAP4K1 67/4885ALDH1A1 2137/4885

“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.