SCHEMBL21863802

SCHEMBL21863802

Cc1ccc(Oc2ccc(Br)c(F)c2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.43
KDR P35968 1/20 0.43
HSPB1 P04792 1/20 0.39
AR P10275 4/20 0.38
SLC6A4 P31645 6/20 0.37
HTR2A P28223 3/20 0.37
KCNH2 Q12809 2/20 0.37
PPARG P37231 1/20 0.36
MAPK14 Q16539 1/20 0.36
HTR1A P08908 1/20 0.36
SLC6A2 P23975 1/20 0.36
EPAS1 Q99814 2/20 0.35

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
SCHEMBL22199022 0.82 HSPB1 (0.45) HSPB1ARSLC6A4HTR2AKCNH2
SCHEMBL29570973 0.80
SCHEMBL157146 0.80
SCHEMBL328380 0.79 SLC6A4 (0.50) HSPB1ARSLC6A4HTR2AKCNH2
SCHEMBL26186321 0.79 SLC6A4 (0.39) HSPB1SLC6A4HTR2AKCNH2PPARG
Fluoride SCHEMBL28080565 0.78 KDM1A (0.39) KCNH2
SCHEMBL6741205 0.78 KDM1A (0.39) KCNH2
SCHEMBL26493853 0.78 ACHE (0.46) SLC6A4KCNH2HTR1ASLC6A2
SCHEMBL22199016 0.77 ACHE (0.50) HSPB1ARMAPK14
SCHEMBL27115313 0.77 ALDH1A1 (0.54) ARSLC6A4PPARGHTR1ASLC6A2

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-11142527-B2 Dihydropyrimidine compounds and uses thereof in medicine SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-10-12 US disclosed
US-20200115381-A1 DIHYDROPYRIMIDINE COMPOUNDS AND USES THEREOF IN MEDICINE NORTH & SOUTH BROTHER PHARMACY INVESTMENT COMPANY LIMITED (CN) 2020-04-16 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 (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-20200115381-A1 DIHYDROPYRIMIDINE COMPOUNDS AND USES THEREOF IN MEDICINE DPYD, SLC10A1, DHODH EGFR 4439/4885KDR 3343/4885HSPB1 3552/4885
US-11142527-B2 Dihydropyrimidine compounds and uses thereof in medicine DPYD, SLC10A1, DHODH EGFR 4439/4885KDR 3343/4885HSPB1 3552/4885

“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.