SCHEMBL2811224

SCHEMBL2811224

CC(=CSc1ccccc1)C(=O)Nc1ccc(C(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.49
PTPN1 P18031 1/20 0.48
PTPN6 P29350 1/20 0.48
PTPN11 Q06124 1/20 0.48
RAB9A P51151 4/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
MAPT P10636 4/20 0.45
NPC1 O15118 3/20 0.45
ALDH1A1 P00352 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
EPHX1 P07099 1/20 0.44
KIF11 P52732 1/20 0.42
CASP3 P42574 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SENP8 Q96LD8 1/20 0.42

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
SCHEMBL2811221 1.00 EGFR (0.49) EGFRPTPN1PTPN6PTPN11RAB9A
SCHEMBL2812834 0.87 HSD17B10 (0.53) RAB9AMAPTNPC1ALDH1A1CYP3A4
SCHEMBL2812831 0.87 HSD17B10 (0.53) RAB9AMAPTNPC1ALDH1A1CYP3A4
SCHEMBL2812062 0.85 ALDH1A1 (0.50) EGFRRAB9AMAPTNPC1ALDH1A1
SCHEMBL2812064 0.85 ALDH1A1 (0.50) EGFRRAB9AMAPTNPC1ALDH1A1
SCHEMBL2810980 0.81 RAB9A (0.52) PTPN1RAB9ACRHBPCRHR2MAPT
SCHEMBL2810976 0.81 RAB9A (0.52) PTPN1RAB9ACRHBPCRHR2MAPT
SCHEMBL2809174 0.81 RAB9A (0.47) EGFRRAB9AMAPTNPC1ALDH1A1
SCHEMBL2809170 0.81 RAB9A (0.47) EGFRRAB9AMAPTNPC1ALDH1A1
SCHEMBL2810265 0.79 NAPRT (0.47) EGFRRAB9AMAPTNPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8278473-B2 Alpha, beta-unsaturated imidate compound and pesticidal composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-02 US disclosed
US-20100240729-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-23 US disclosed
WO-2009064031-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-22 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-20100240729-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME OXER1, CBR1, DEGS1 EGFR 2286/4885PTPN1 4056/4885PTPN6 4399/4885

“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.