SCHEMBL2994640

SCHEMBL2994640

CCc1ccc(-c2ccc(Cl)cc2)cc1C1C(=O)CC2(CCOCC2)CC1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
MAP4K4 O95819 1/20 0.33
PTGS1 P23219 2/20 0.32
PTGS2 P35354 2/20 0.32
PRKDC P78527 3/20 0.32
TAAR1 Q96RJ0 1/20 0.32
PGR P06401 2/20 0.31
CACNB4 O00305 1/20 0.31
CACNA1A O00555 1/20 0.31
CACNA1G O43497 1/20 0.31
CACNG3 O60359 1/20 0.31
CACNA1F O60840 1/20 0.31
CACNA1H O95180 1/20 0.31
CACNB3 P54284 1/20 0.31
CACNA2D1 P54289 1/20 0.31
CACNG7 P62955 1/20 0.31
CACNA1B Q00975 1/20 0.31
CACNA1D Q01668 1/20 0.31

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
SCHEMBL417562 0.81 BACE1 (0.33) ALDH1A1HSD17B10TDP2APPBACE1
SCHEMBL13366544 0.74 CACNB4 (0.33) HDAC1HDAC2CACNB4CACNA1ACACNA1G
SCHEMBL10079443 0.73 CYP11B2 (0.38) CYP11B2HDAC1HDAC2MAP4K4PTGS1
SCHEMBL431252 0.73 PGR (0.35) PTGS2TAAR1PGRKDM4EALDH1A1
SCHEMBL3034996 0.73 PGR (0.40) HDAC1HDAC2TAAR1PGRALDH1A1
SCHEMBL12239210 0.73 HDAC1 (0.36) HDAC1HDAC2
SCHEMBL452406 0.71 TAAR1 (0.36) HDAC1HDAC2TAAR1PGRCACNB4
SCHEMBL452407 0.71 TAAR1 (0.36) HDAC1HDAC2TAAR1PGRCACNB4
SCHEMBL3032828 0.70 PGR (0.32) HDAC1HDAC2TAAR1PGRCACNB4
SCHEMBL3032825 0.70 PGR (0.32) HDAC1HDAC2TAAR1PGRCACNB4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8084649-B2 Herbicides SYNGENTA CROP PROTECTION, INC. (US) 2011-12-27 US disclosed
US-20100173774-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-07-08 US disclosed
EP-2121584-A2 NOVEL HERBICIDES Syngeta Participations AG (CH) 2009-11-25 EP disclosed
WO-2008110308-A2 NOVEL HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-09-18 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-20100173774-A1 NOVEL HERBICIDES DDT, HDHD5, HPD CYP11B2 1698/4885HDAC1 3069/4885HDAC2 2432/4885

“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.