SCHEMBL20616396

SCHEMBL20616396

COC(=O)[C@H]1CC[C@@H](Oc2cc(F)cc(Br)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 8/20 0.41
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ACACB O00763 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
DGAT1 O75907 6/20 0.35
SOAT1 P35610 4/20 0.35
ATR Q13535 1/20 0.34

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
SCHEMBL20616140 1.00 EPHX2 (0.41) EPHX2ALDH1A1HTTSMN1; SMN2ACACB
SCHEMBL21863862 1.00 EPHX2 (0.41) EPHX2ALDH1A1HTTSMN1; SMN2ACACB
SCHEMBL2474297 0.90 EPHX2 (0.48) EPHX2ACACBFFAR4DGAT1SOAT1
SCHEMBL2474293 0.90 EPHX2 (0.48) EPHX2ACACBFFAR4DGAT1SOAT1
SCHEMBL21839163 0.85 ACSL1 (0.41) EPHX2FFAR4DGAT1SOAT1
SCHEMBL28897631 0.85 ACSL1 (0.41) EPHX2FFAR4DGAT1SOAT1
SCHEMBL21838823 0.85 ACSL1 (0.41) EPHX2FFAR4DGAT1SOAT1
SCHEMBL30663064 0.80 SLC6A4 (0.49) EPHX2ALDH1A1HTTSMN1; SMN2
SCHEMBL2471996 0.79 EPHX2 (0.56) EPHX2DGAT1SOAT1
SCHEMBL2471998 0.79 EPHX2 (0.56) EPHX2DGAT1SOAT1

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 3 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
WO-2019001396-A1 DIHYDROPYRIMIDINE COMPOUNDS AND USES THEREOF IN MEDICINE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-01-03 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-20200115381-A1 DIHYDROPYRIMIDINE COMPOUNDS AND USES THEREOF IN MEDICINE DPYD, SLC10A1, DHODH EPHX2 1617/4885ALDH1A1 798/4885HTT 334/4885
US-11142527-B2 Dihydropyrimidine compounds and uses thereof in medicine DPYD, SLC10A1, DHODH EPHX2 1617/4885ALDH1A1 798/4885HTT 334/4885

“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.