SCHEMBL17050837

SCHEMBL17050837

CCOc1ccc(Oc2ccc(C=O)cn2)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACACB O00763 7/20 0.62
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 6/20 0.50
L3MBTL1 Q9Y468 4/20 0.50
ACACA Q13085 2/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
POLB P06746 2/20 0.43
TACR2 P21452 1/20 0.41
ERN1 O75460 1/20 0.41
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TTR P02766 1/20 0.39
MAPT P10636 2/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL17050831 0.88 KDM4E (0.55) ACACBKDM4EALDH1A1L3MBTL1ACACA
SCHEMBL17050453 0.82 ACACB (0.53) ACACBKDM4EALDH1A1L3MBTL1ACACA
SCHEMBL17050518 0.81 ACACB (0.70) ACACBACACACYP3A4CYP2C9POLB
SCHEMBL17050839 0.80 TTR (0.48) ACACBKDM4EALDH1A1L3MBTL1ACACA
SCHEMBL17050832 0.80 ACACB (0.57) ACACBACACACYP3A4CYP2C9POLB
SCHEMBL17050830 0.80 ACACB (0.52) ACACBKDM4EL3MBTL1ACACACYP3A4
SCHEMBL17050840 0.79 ACACB (0.68) ACACBACACACYP3A4CYP2C9POLB
SCHEMBL17050834 0.79 ACACB (0.71) ACACBACACACYP3A4CYP2C9POLB
SCHEMBL8006810 0.78 ALDH1A1 (0.61) ACACBKDM4EALDH1A1L3MBTL1POLB
SCHEMBL17050525 0.78 ACACB (1.00) ACACBACACACYP3A4CYP2C9

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-20150246938-A1 NOVEL OLEFIN DERIVATIVE SHIONOGI & CO., LTD. (JP) 2015-09-03 US disclosed
US-20150246938-A1 NOVEL OLEFIN DERIVATIVE SHIONOGI & CO., LTD. (JP) 2015-09-03 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-20150246938-A1 NOVEL OLEFIN DERIVATIVE ACSS2, ACACB, ACAT2 ACACB 2/4885KDM4E 2675/4885ALDH1A1 408/4885

“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.