SCHEMBL10135989

SCHEMBL10135989

COCCOCCOCCOCCOCCOCCOCCOC(=O)C(C#N)=C(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.52
ALDH1A1 P00352 4/20 0.52
MAPK1 P28482 2/20 0.52
TSHR P16473 1/20 0.42
MAPT P10636 2/20 0.40
KDM4E B2RXH2 2/20 0.40
HSP90AA1 P07900 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
APP P05067 3/20 0.39
XBP1 P17861 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HPGD P15428 1/20 0.37
ABCB11 O95342 1/20 0.36
CYP3A4 P08684 1/20 0.36
ADRA2B P18089 1/20 0.36
OPRD1 P41143 1/20 0.36
SCN5A Q14524 1/20 0.36
PKM P14618 1/20 0.36

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
SCHEMBL12253186 0.96 LMNA (0.55) LMNAALDH1A1MAPK1TSHRMAPT
SCHEMBL12253191 0.89 ALDH1A1 (0.58) LMNAALDH1A1MAPK1MAPTKDM4E
SCHEMBL16486985 0.88 ALDH1A1 (0.56) LMNAALDH1A1MAPK1TSHRMAPT
SCHEMBL11421380 0.87 ALDH1A1 (0.47) LMNAALDH1A1MAPK1TSHRMAPT
SCHEMBL11408376 0.85 ALDH1A1 (0.55) LMNAALDH1A1MAPK1MAPTKMT2A
SCHEMBL28097992 0.84 MAPK1 (0.50) LMNAALDH1A1MAPK1TSHRMAPT
SCHEMBL11983345 0.84 ALDH1A1 (0.47) LMNAALDH1A1MAPK1MAPTKMT2A
SCHEMBL11401792 0.83 ALDH1A1 (0.49) LMNAALDH1A1MAPK1MAPTKMT2A
SCHEMBL4743488 0.83 ALDH1A1 (0.63) LMNAALDH1A1MAPK1TSHRMAPT
SCHEMBL32669188 0.83 LMNA (0.59) LMNAALDH1A1MAPK1MAPTSMN1; SMN2

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-9232785-B2 Method for reducing sunburn damage in plants BASF SE (DE) 2016-01-12 US disclosed
US-8748347-B2 Method for combating harmful fungi BASF SE (DE) 2014-06-10 US disclosed
US-20120083497-A1 Method for Combating Harmful Fungi BASF SE (DE) 2012-04-05 US disclosed
US-20120017503-A1 METHOD FOR REDUCING SUNBURN DAMAGE IN PLANTS BASF SE (DE) 2012-01-26 US disclosed
US-20110237665-A1 Agrochemical Composition Comprising Pesticide and UV Absorber BASF SE (DE) 2011-09-29 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 (3 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-20110237665-A1 Agrochemical Composition Comprising Pesticide and UV Absorber DDT, CRY1, STOM LMNA 4116/4885ALDH1A1 695/4885MAPK1 4848/4885
US-20120017503-A1 METHOD FOR REDUCING SUNBURN DAMAGE IN PLANTS UNG, ERCC5, ERCC4 LMNA 465/4885ALDH1A1 682/4885MAPK1 3970/4885
US-20120083497-A1 Method for Combating Harmful Fungi BROX, CRY1, GUSB LMNA 2775/4885ALDH1A1 2453/4885MAPK1 3296/4885

“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.