SCHEMBL16210587

SCHEMBL16210587

COc1ccc2c(c1)CC/C(=C/c1ccccc1F)C2=O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 4/20 0.76
CYP27A1 Q02318 2/20 0.74
CYP24A1 Q07973 4/20 0.73
MIF P14174 4/20 0.69
ABCB1 P08183 1/20 0.63
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
SMN1; SMN2 Q16637 4/20 0.61
HPGD P15428 2/20 0.61
LMNA P02545 2/20 0.61
ALDH1A1 P00352 3/20 0.60
MAPT P10636 3/20 0.60
EGFR P00533 1/20 0.60
KDM4E B2RXH2 1/20 0.60
NFKB1 P19838 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60
CYP19A1 P11511 1/20 0.59

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
SCHEMBL16210588 1.00 CYP26A1 (0.76) CYP26A1CYP27A1CYP24A1MIFABCB1
SCHEMBL229133 0.85 CYP26A1 (0.76) CYP26A1CYP27A1CYP24A1MIFABCB1
SCHEMBL229132 0.85 CYP26A1 (0.76) CYP26A1CYP27A1CYP24A1MIFABCB1
SCHEMBL8169114 0.82 MIF (1.00) CYP26A1CYP27A1CYP24A1MIFABCB1
SCHEMBL8169116 0.82 MIF (1.00) CYP26A1CYP27A1CYP24A1MIFABCB1
SCHEMBL9619490 0.81 NFE2L2 (0.71) CYP26A1CYP27A1CYP24A1MIFABCB1
SCHEMBL9619624 0.81 ALDH1A1 (0.79) CYP26A1CYP27A1CYP24A1MIFABCB1
SCHEMBL28096059 0.80 CYP26A1 (0.67) CYP26A1CYP27A1CYP24A1MIFABCB1
SCHEMBL17077391 0.80 EGFR (0.90) EGFR
SCHEMBL17077394 0.80 EGFR (0.90) EGFR

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-9796676-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2017-10-24 US disclosed
US-20160251312-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2016-09-01 US disclosed
US-9357781-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2016-06-07 US disclosed
US-20140329674-A1 Honeybee Repellents and Uses Thereof INSCENT, INC. (US) 2014-11-06 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 (2 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-20160251312-A1 Honeybee Repellents and Uses Thereof ACHE, AHNAK, L3MBTL3 CYP26A1 3233/4885CYP27A1 3266/4885CYP24A1 2138/4885
US-20140329674-A1 Honeybee Repellents and Uses Thereof ACHE, AHNAK, L3MBTL3 CYP26A1 3233/4885CYP27A1 3266/4885CYP24A1 2138/4885

“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.