SCHEMBL16211174

SCHEMBL16211174

O=C(C=Cc1c[nH]c2ccccc12)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.84
MAPT P10636 7/20 0.84
KMT2A Q03164 7/20 0.84
ALDH1A1 P00352 6/20 0.84
NPC1 O15118 5/20 0.84
RAB9A P51151 5/20 0.84
HPGD P15428 3/20 0.84
SMN1; SMN2 Q16637 2/20 0.84
NFKB1 P19838 1/20 0.84
NFKB2 Q00653 1/20 0.84
RELA Q04206 1/20 0.84
KDM4E B2RXH2 4/20 0.76
LMNA P02545 3/20 0.76
CYP1A2 P05177 2/20 0.76
CYP3A4 P08684 1/20 0.76
CYP2D6 P10635 1/20 0.76
CYP2C9 P11712 1/20 0.76
PKM P14618 1/20 0.76
ALOX12 P18054 1/20 0.76
CYP2C19 P33261 1/20 0.76

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
SCHEMBL16211173 1.00 MEN1 (0.84) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL16210970 0.93 MEN1 (0.91) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL16210969 0.93 MEN1 (0.91) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL656595 0.91 MAPT (1.00) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL30090660 0.91 MAPT (1.00) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL656596 0.91 MAPT (1.00) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL30734355 0.91 MAPT (1.00) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL13723439 0.83 MAPT (0.79) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL13723443 0.83 MAPT (0.79) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL30090669 0.83 MAPT (0.79) MEN1MAPTKMT2AALDH1A1NPC1

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 6 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
EP-2704578-B1 USE OF HONEYBEE REPELLENTS INSCENT INC (US) 2016-08-31 EP disclosed
US-9357781-B2 Honeybee repellents and uses thereof INSCENT, INC. (US) 2016-06-07 US disclosed
WO-2014179785-A1 IMPROVED HONEYBEE REPELLENTS AND USES THEREOF INSCENT, INC. (US) 2014-11-06 WO 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 MEN1 2382/4885MAPT 1877/4885KMT2A 794/4885
US-20140329674-A1 Honeybee Repellents and Uses Thereof ACHE, AHNAK, L3MBTL3 MEN1 2382/4885MAPT 1877/4885KMT2A 794/4885

“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.