SCHEMBL29918375

SCHEMBL29918375

OCc1ccc(Oc2ccnc(Cl)c2)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.53
TTR P02766 2/20 0.40
MET P08581 2/20 0.40
PTGDR2 Q9Y5Y4 2/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
KDR P35968 2/20 0.38
P2RX3 P56373 5/20 0.38
PPARD Q03181 1/20 0.37
ROCK2 O75116 1/20 0.36
ROCK1 Q13464 1/20 0.36
BRAF P15056 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
SCHEMBL14656193 1.00 RECQL (0.53) RECQLTTRMETPTGDR2NPC1
SCHEMBL15901230 0.86 TTR (0.42) RECQLTTRMETPTGDR2KDR
SCHEMBL19767022 0.83 GRM2 (0.45) TTRMETKDRP2RX3PPARD
SCHEMBL29918291 0.83 GRM2 (0.45) TTRMETKDRP2RX3PPARD
SCHEMBL5151199 0.83 HTR2A (0.46) METKDRP2RX3ROCK2BRAF
SCHEMBL29918331 0.83 RECQL (0.51) RECQLP2RX3
SCHEMBL15900902 0.83 RECQL (0.51) RECQLP2RX3
SCHEMBL15834512 0.82 MET (0.39) RECQLTTRMETPTGDR2KDR
SCHEMBL24999961 0.81 MET (0.39) RECQLTTRMETKDRP2RX3
SCHEMBL14662000 0.81 KDR (0.46) TTRMETKDRBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230044787-A1 TRICYCLE DIHYDROIMIDAZOPYRIMIDONE DERIVATIVE, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI SIMRD BIOTECHNOLOGY CO., LTD. (CN) 2023-02-09 US disclosed
EP-4056571-A1 TRICYCLIC DIHYDROIMIDAZOPYRIMIDONE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF Shanghai Simr Biotechnology Co., Ltd. (CN) 2022-09-14 EP 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 (1 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-20230044787-A1 TRICYCLE DIHYDROIMIDAZOPYRIMIDONE DERIVATIVE, PREPARATION METHOD THEREOF, PHARMACEUTICAL COMPOSITION AND USE THEREOF LYPLAL1, LYPLA1, LYPLA2 RECQL 1345/4885TTR 2161/4885MET 4581/4885

“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.