SCHEMBL17200293

SCHEMBL17200293

Cc1ncnc(C)c1-c1ccc(Oc2ncnc3ccsc23)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MET P08581 9/20 0.46
KDR P35968 3/20 0.46
EGFR P00533 1/20 0.46
KIT P10721 1/20 0.46
FLT3 P36888 1/20 0.46
TRPA1 O75762 5/20 0.43
MRGPRX1 Q96LB2 1/20 0.39
DRD1 P21728 2/20 0.38
AURKA O14965 2/20 0.37
TEK Q02763 2/20 0.37
AURKB Q96GD4 2/20 0.37
PDGFRB P09619 1/20 0.37
FLT4 P35916 1/20 0.37
AXL P30530 1/20 0.36
MKNK1 Q9BUB5 1/20 0.36
MKNK2 Q9HBH9 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
SCHEMBL17200372 0.88 MET (0.38) METKDREGFRKITFLT3
SCHEMBL17200336 0.85 DRD1 (0.53) METKDREGFRKITFLT3
SCHEMBL17200299 0.84 DRD1 (0.52) METKDREGFRKITFLT3
SCHEMBL17200302 0.83 DRD1 (0.43) METTRPA1MRGPRX1DRD1
SCHEMBL14771453 0.81 MET (0.47) METKDREGFRKITFLT3
SCHEMBL17211794 0.81 DRD1 (0.45) METMRGPRX1DRD1AXLMKNK1
SCHEMBL17200327 0.80 DRD1 (0.42) METKDREGFRKITFLT3
SCHEMBL17211795 0.79 DRD1 (0.52) METKDREGFRDRD1
SCHEMBL17200320 0.74 DRD1 (0.53) METKDREGFRDRD1
SCHEMBL15698731 0.72 CYP1A2 (0.52) KITPDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3134087-B1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER (US) 2020-03-18 EP disclosed
EP-3134087-B1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER (US) 2020-03-18 EP disclosed
US-9688698-B2 Heteroaromatic compounds and their use as dopamine D1 ligands PFIZER INC. (US) 2017-06-27 US disclosed
US-9688698-B2 Heteroaromatic compounds and their use as dopamine D1 ligands PFIZER INC. (US) 2017-06-27 US disclosed
US-9688698-B2 Heteroaromatic compounds and their use as dopamine D1 ligands PFIZER INC. (US) 2017-06-27 US disclosed
WO-2015162515-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2015-10-29 WO disclosed
US-20150307522-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2015-10-29 US disclosed
US-20150307522-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2015-10-29 US disclosed
US-20150307522-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS PFIZER INC. (US) 2015-10-29 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 (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-20150307522-A1 HETEROAROMATIC COMPOUNDS AND THEIR USE AS DOPAMINE D1 LIGANDS DRD2, DRD1, DRD4 MET 2358/4885KDR 2507/4885EGFR 1049/4885

“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.