SCHEMBL21664409

SCHEMBL21664409

COc1cc2ncnc(Cl)c2cc1C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 3/20 0.58
EGFR P00533 11/20 0.48
BRAF P15056 3/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
LCK P06239 1/20 0.41
KDR P35968 3/20 0.41
FLT1 P17948 1/20 0.41
CSF1R P07333 2/20 0.41
PDE1B Q01064 1/20 0.40
RAF1 P04049 1/20 0.40
RIPK2 O43353 1/20 0.40
SRC P12931 1/20 0.40
NOD1 Q9Y239 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
SCHEMBL1373577 0.94 ENPP1 (0.58) ENPP1EGFRBRAFABCG2KDR
SCHEMBL29359187 0.82 ENPP1 (0.81) ENPP1EGFRLCKKDRFLT1
SCHEMBL364049 0.82 ENPP1 (0.81) ENPP1EGFRLCKKDRFLT1
SCHEMBL24393053 0.82 EGFR (0.48) EGFRBRAFABCG2CSF1R
SCHEMBL21664408 0.82 EGFR (0.48) EGFRBRAFABCG2LCKKDR
SCHEMBL3528775 0.81 ENPP1 (0.70) ENPP1EGFRBRAFABCG2KDR
Hydrochloric Acid SCHEMBL3526531 0.80 ENPP1 (0.79) ENPP1EGFRLCKKDRFLT1
SCHEMBL24008957 0.80 ENPP1 (0.63) ENPP1EGFRKDRFLT1
SCHEMBL24391772 0.79 EGFR (0.46) ENPP1EGFRBRAFABCG2KDR
SCHEMBL16636797 0.79 PDE4A (0.40) ENPP1EGFRBRAFKDRRAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11752153-B2 Substituted quinazoline sulfonamides as thioredoxin interacting protein (TXNIP) inhibitors SOUTHERN RESEARCH INSTITUTE (US) 2023-09-12 US disclosed
US-20230172932-A1 SUBSTITUTED QUINAZOLINE SULFONAMIDES AS THIOREDOXIN INTERACTING PROTEIN (TXNIP) INHIBITORS SOUTHERN RESEARCH INSTITUTE (US) 2023-06-08 US disclosed
US-11524010-B2 Substituted quinazoline sulfonamides as thioredoxin interacting protein (TXNIP) inhibitors SOUTHERN RESEARCH INSTITUTE (US) 2022-12-13 US disclosed
US-20210369713-A1 SUBSTITUTED QUINAZOLINE SULFONAMIDES AS THIOREDOXIN INTERACTING PROTEIN (TXNIP) INHIBITORS SOUTHERN RESEARCH INSTITUTE (US) 2021-12-02 US disclosed
US-20200038402-A1 SUBSTITUTED QUINAZOLINE SULFONAMIDES AS THIOREDOXIN INTERACTING PROTEIN (TXNIP) INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-02-06 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 (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-20200038402-A1 SUBSTITUTED QUINAZOLINE SULFONAMIDES AS THIOREDOXIN INTERACTING PROTEIN (TXNIP) INHIBITORS TXN, TXN2, TXNRD1 ENPP1 2457/4885EGFR 4829/4885BRAF 1473/4885
US-11524010-B2 Substituted quinazoline sulfonamides as thioredoxin interacting protein (TXNIP) inhibitors TXN, TXNL1, TXN2 ENPP1 2704/4885EGFR 4824/4885BRAF 1044/4885
US-20210369713-A1 SUBSTITUTED QUINAZOLINE SULFONAMIDES AS THIOREDOXIN INTERACTING PROTEIN (TXNIP) INHIBITORS TXN, TXNL1, TXN2 ENPP1 2704/4885EGFR 4824/4885BRAF 1044/4885
US-20230172932-A1 SUBSTITUTED QUINAZOLINE SULFONAMIDES AS THIOREDOXIN INTERACTING PROTEIN (TXNIP) INHIBITORS TXN, TXNL1, TXN2 ENPP1 2704/4885EGFR 4824/4885BRAF 1044/4885
US-11752153-B2 Substituted quinazoline sulfonamides as thioredoxin interacting protein (TXNIP) inhibitors TXN, TXNL1, TXN2 ENPP1 2704/4885EGFR 4824/4885BRAF 1044/4885

“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.