SCHEMBL1966187

SCHEMBL1966187

C/C(COc1ccc(F)c(F)c1)=C(/C)CC(C(=O)C(C)(C)C)n1cncn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.35
HSP90AA1 P07900 2/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 2/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
NPC1 O15118 2/20 0.33
MAOB P27338 1/20 0.32
AOC3 Q16853 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
ADRA1A P35348 1/20 0.32
MCHR1 Q99705 1/20 0.32
KDR P35968 1/20 0.32
CYP19A1 P11511 3/20 0.32

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
SCHEMBL2021950 1.00 MAPT (0.47) MAPTCYP3A4TSHRHSP90AA1POLB
SCHEMBL2020533 0.81 MEN1 (0.47) CYP3A4HSP90AA1POLBRAB9ACASP3
SCHEMBL1967631 0.81 MEN1 (0.47) CYP3A4HSP90AA1POLBRAB9ACASP3
SCHEMBL1936250 0.80 MAPT (0.47) MAPTCYP3A4TSHRHSP90AA1POLB
SCHEMBL2179492 0.80 MAPT (0.47) MAPTCYP3A4TSHRHSP90AA1POLB
SCHEMBL2023866 0.71 MAPT (0.52) MAPTCYP3A4HSP90AA1POLBTDP1
SCHEMBL1966934 0.71 MAPT (0.52) MAPTCYP3A4HSP90AA1POLBTDP1
SCHEMBL3234030 0.70 MAPK1 (0.40) MAPTPOLBRAB9ANPC1KMT2A
SCHEMBL11641005 0.70 MAPT (0.56) MAPTCYP3A4HSP90AA1POLBRAB9A
SCHEMBL11049095 0.70 MAPT (0.58) MAPTCYP3A4TSHRHSP90AA1POLB

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-20110160055-A1 Imidazole and Triazole Compounds as Fungicides BASF SE (DE) 2011-06-30 US disclosed
EP-2334655-A1 IMIDAZOLE AND TRIAZOLE COMPOUNDS AS FUNGICIDES BASF SE (DE) 2011-06-22 EP disclosed
WO-2010028985-A1 IMIDAZOLE AND TRIAZOLE COMPOUNDS AS FUNGICIDES BASF SE (DE) 2010-03-18 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-20110160055-A1 Imidazole and Triazole Compounds as Fungicides CYP51A1, CYP3A43, CYP3A5 MAPT 1207/4885CYP3A4 9/4885TSHR 3073/4885

“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.