SCHEMBL20567795

SCHEMBL20567795

O=C(OC1(Cn2cnc3c(cnn3-c3ccc(-c4ccccc4)nc3)c2=O)CCNCC1)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.44
TSHR P16473 4/20 0.44
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
USP7 Q93009 9/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
RAB9A P51151 2/20 0.43
USP19 O94966 1/20 0.42
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL28349670 0.90 RAB9A (0.53) SMN1; SMN2TSHRMEN1POLBMAPT
Trifluoroacetic Acid SCHEMBL17869197 0.87 USP7 (0.51) USP7RAB9AUSP19
SCHEMBL20567604 0.87 SMN1; SMN2 (0.53) SMN1; SMN2TSHRMEN1POLBMAPT
SCHEMBL17881681 0.84 USP7 (0.54) SMN1; SMN2USP7L3MBTL1RAB9AKDM4E
SCHEMBL17877669 0.79 USP7 (0.54) USP7USP19
Trifluoroacetic Acid SCHEMBL32668814 0.79 USP7 (0.56) SMN1; SMN2TSHRMEN1POLBMAPT
SCHEMBL21228973 0.79 USP19 (0.47) SMN1; SMN2TSHRKMT2AUSP7RAB9A
Trifluoroacetic Acid SCHEMBL17869376 0.77 USP7 (0.61) SMN1; SMN2TSHRUSP7RAB9AUSP19
SCHEMBL17869575 0.76 USP7 (0.58) USP7LMNA
SCHEMBL32668480 0.75 USP7 (0.59) SMN1; SMN2USP7L3MBTL1RAB9AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-10377760-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors USP7, UBA7, UBXN1 SMN1; SMN2 1753/4885TSHR 3275/4885MEN1 1380/4885
US-10934299-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors USP7, UBA7, UBXN1 SMN1; SMN2 1782/4885TSHR 3130/4885MEN1 1492/4885
US-20180339988-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, UBXN1 SMN1; SMN2 1753/4885TSHR 3275/4885MEN1 1380/4885

“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.