SCHEMBL17869877

SCHEMBL17869877

O=c1[nH]c(CC2(O)CCNCC2)nc2[nH]ncc12

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.42
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 9/20 0.40
RECQL P46063 1/20 0.40
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
POLB P06746 1/20 0.37
TP53 P04637 1/20 0.36
XDH P47989 1/20 0.36

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
SCHEMBL7883156 0.70 PDE9A (0.49) SMN1; SMN2HTTL3MBTL1ALDH1A1RECQL
SCHEMBL7876154 0.68 PDE9A (0.56) SMN1; SMN2HTTL3MBTL1ALDH1A1RECQL
Oxypurinol SCHEMBL8256863 0.66 ALDH1A1 (0.53) SMN1; SMN2HTTL3MBTL1ALDH1A1RECQL
SCHEMBL16712554 0.66 ALDH1A1 (0.59) SMN1; SMN2HTTALDH1A1RECQLNPC1
SCHEMBL17869808 0.66 USP7 (0.38)
SCHEMBL20214280 0.64 ALDH1A1 (0.50) SMN1; SMN2HTTALDH1A1RECQLNPC1
SCHEMBL481407 0.63 DYRK1A (0.53) SMN1; SMN2HTTALDH1A1RECQLNPC1
SCHEMBL6642975 0.63 ALDH1A1 (0.53) SMN1; SMN2HTTALDH1A1RECQLNPC1
SCHEMBL4497867 0.63 ALDH1A1 (0.57) SMN1; SMN2HTTALDH1A1RECQLNPC1
SCHEMBL20213747 0.62 GAA (0.49) SMN1; SMN2HTTALDH1A1RECQLNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018030-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2024-06-25 US disclosed
US-20210332052-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2021-10-28 US disclosed
US-10934299-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors VALO EARLY DISCOVERY, INC. (US) 2021-03-02 US disclosed
US-10377760-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors FORMA THERAPEUTICS, INC. (US) 2019-08-13 US disclosed
US-20180339988-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2018-11-29 US disclosed
US-9902728-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors FORMA THERAPEUTICS, INC. (US) 2018-02-27 US disclosed
US-20160185785-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2016-06-30 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 (6 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-10377760-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors USP7, UBA7, UBXN1 SMN1; SMN2 1753/4885HTT 1292/4885L3MBTL1 1264/4885
US-12018030-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors USP7, UBA7, UBXN1 SMN1; SMN2 1782/4885HTT 1255/4885L3MBTL1 1217/4885
US-20210332052-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, UBXN1 SMN1; SMN2 1782/4885HTT 1255/4885L3MBTL1 1217/4885
US-20160185785-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, UBXN1 SMN1; SMN2 1782/4885HTT 1255/4885L3MBTL1 1217/4885
US-10934299-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors USP7, UBA7, UBXN1 SMN1; SMN2 1782/4885HTT 1255/4885L3MBTL1 1217/4885
US-20180339988-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, UBXN1 SMN1; SMN2 1753/4885HTT 1292/4885L3MBTL1 1264/4885

“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.