SCHEMBL10207912

SCHEMBL10207912

Cc1ccc(-c2ccc(F)c(F)c2)cc1C1=C(O)CC(CC2CCOCC2)CC1=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 8/20 0.38
▸ ACACA Q13085 8/20 0.38
▸ GRIN2B Q13224 3/20 0.33
▸ GRIN1 Q05586 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ ABL1 P00519 2/20 0.33
▸ RPS6KA3 P51812 1/20 0.31
▸ OPRL1 P41146 1/20 0.31
▸ GABRA5 P31644 1/20 0.31
▸ CYP11B1 P15538 1/20 0.30
▸ CYP11B2 P19099 1/20 0.30
▸ PDE3B Q13370 1/20 0.30
▸ PDE3A Q14432 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ POLB P06746 1/20 0.30

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
SCHEMBL15215687 1.00 ACACB (0.38) ACACBACACAGRIN2BGRIN1CYP1A2
SCHEMBL10207926 0.95 ACACB (0.38) ACACBACACAGRIN2BGRIN1CYP1A2
SCHEMBL10207897 0.91 ACACB (0.40) ACACBACACAGRIN2BCYP11B1CYP11B2
SCHEMBL10207911 0.91 HDAC1 (0.38) ACACBACACAGRIN2BABL1OPRL1
SCHEMBL10207888 0.89 ACACB (0.44) ACACBACACA
SCHEMBL10207932 0.89 GPR84 (0.34) ACACBACACAABL1OPRL1
SCHEMBL10207933 0.89 ACACB (0.35) ACACBACACAGRIN2BGRIN1CYP1A2
SCHEMBL10207892 0.89 ACACB (0.38) ACACBACACA
SCHEMBL15215673 0.88 CNR1 (0.36) ACACBACACAPOLB
SCHEMBL10207929 0.86 ACACB (0.40) ACACBACACAPDE3BPDE3A

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
US-8735322-B2 Herbicides SYNGENTA LIMITED (GB) 2014-05-27 — — US disclosed
US-8735322-B2 Herbicides SYNGENTA LIMITED (GB) 2014-05-27 — — US disclosed
US-20120035053-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-09 — — US disclosed
US-20120035053-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-09 — — US disclosed
WO-2010046194-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-04-29 — — 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 (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-20120035053-A1 NOVEL HERBICIDES DDT, HCAR3, HPD ACACB 750/4885ACACA 1724/4885GRIN2B 738/4885

“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.

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