SCHEMBL11940720

SCHEMBL11940720

CCc1ccc(-c2ccc(Cl)cc2Cl)cc1C1=C(O)CCCC1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.39
▸ MAPT P10636 3/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HSD17B1 P14061 3/20 0.36
▸ MARS1 P56192 2/20 0.35
▸ HPD P32754 1/20 0.35
▸ SRD5A2 P31213 1/20 0.35
▸ EDNRB P24530 1/20 0.35
▸ EDNRA P25101 1/20 0.35
▸ HPGD P15428 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ PDK1 Q15118 1/20 0.34
▸ PDK2 Q15119 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
SCHEMBL12119099 0.93 HSD17B1 (0.40) PTGS2MAPTHSD17B1MARS1SRD5A2
SCHEMBL11940724 0.90 BRD4 (0.37) MAPTHSD17B1HPDHPGDKDM4E
SCHEMBL11940721 0.89 HPD (0.40) PTGS2MAPTHSD17B1HPDHPGD
SCHEMBL11940722 0.88 MAPT (0.36) MAPTMEN1THRBRECQLKMT2A
SCHEMBL11940679 0.88 HSD17B1 (0.39) MAPTMEN1THRBRECQLKMT2A
SCHEMBL11940730 0.86 AHR (0.39) PTGS2MAPTMEN1THRBRECQL
SCHEMBL11940726 0.84 POLB (0.42) PTGS2MAPTTHRBHSD17B1AHR
SCHEMBL11940728 0.84 HSD17B1 (0.34) PTGS2MAPTMEN1THRBRECQL
SCHEMBL11940719 0.83 HSD17B1 (0.34) PTGS2MAPTMEN1THRBRECQL
SCHEMBL11940727 0.83 MAPT (0.37) PTGS2MAPTMEN1THRBRECQL

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-8741806-B2 Herbicides SYNGENTA LIMITED (GB) 2014-06-03 — — US disclosed
US-8741806-B2 Herbicides SYNGENTA LIMITED (GB) 2014-06-03 — — US disclosed
US-20120190545-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-07-26 — — US disclosed
US-20120190545-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-07-26 — — US disclosed
WO-2011006543-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2011-01-20 — — 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-20120190545-A1 NOVEL HERBICIDES DDT, CYP1B1, CYP1A1 PTGS2 3383/4885MAPT 3984/4885MEN1 4244/4885

“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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