SCHEMBL20188232

SCHEMBL20188232

COc1cccc(CO[Si](C)(C)C(C)(C)C)c1NC(=NN)c1ccco1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 6/20 0.37
ALDH1A1 P00352 3/20 0.37
RAB9A P51151 4/20 0.34
NPC1 O15118 3/20 0.34
LMNA P02545 2/20 0.34
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
ESR1 P03372 1/20 0.33
TP53 P04637 1/20 0.33
ESR2 Q92731 1/20 0.33
HTT P42858 1/20 0.33
NQO2 P16083 1/20 0.33
RECQL P46063 1/20 0.33
UBE2I P63279 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
SAE1 Q9UBE0 1/20 0.33

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
SCHEMBL20188228 1.00 POLB (0.39) POLBTDP1KDM4EALDH1A1RAB9A
SCHEMBL20187956 0.85 POLB (0.41) POLBTDP1KDM4EALDH1A1RAB9A
SCHEMBL20189213 0.81 RAB9A (0.43) POLBTDP1KDM4EALDH1A1RAB9A
SCHEMBL20189212 0.81 RAB9A (0.43) POLBTDP1KDM4EALDH1A1RAB9A
SCHEMBL20189141 0.69 IDO1 (0.44) TDP1KDM4EALDH1A1LMNASMN1; SMN2
SCHEMBL4681216 0.67 IDO1 (0.40) KDM4EALDH1A1NPC1LMNAADORA2A
SCHEMBL23026125 0.66 HPGD (0.41) POLBTDP1KDM4EALDH1A1RAB9A
SCHEMBL19860981 0.66 BACE1 (0.39) KDM4EALDH1A1LMNAHTTHPGD
SCHEMBL20201167 0.64 KMT2A (0.51) KDM4EALDH1A1RAB9ANPC1LMNA
SCHEMBL20189239 0.63 GABRA1 (0.41)

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
EP-3541792-B1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC (US) 2020-12-23 EP disclosed
US-10736883-B2 Triazole furan compounds as agonists of the APJ receptor AMGEN INC. (US) 2020-08-11 US disclosed
EP-3541792-A1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR Amgen Inc. (US) 2019-09-25 EP disclosed
US-20190275008-A1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. (US) 2019-09-12 US disclosed
WO-2018097944-A1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR AMGEN INC. (US) 2018-05-31 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 (2 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-20190275008-A1 TRIAZOLE FURAN COMPOUNDS AS AGONISTS OF THE APJ RECEPTOR TBXA2R, AGTR1, APLNR POLB 4195/4885TDP1 3072/4885KDM4E 4612/4885
US-10736883-B2 Triazole furan compounds as agonists of the APJ receptor TBXA2R, AGTR1, APLNR POLB 4195/4885TDP1 3072/4885KDM4E 4612/4885

“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.