SCHEMBL23095370

SCHEMBL23095370

C/C=C1C(=C/C)\C(=O)c2c(C)cccc2\1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
USP8 P40818 1/20 0.41
DAO P14920 1/20 0.39
NTRK1 P04629 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MYC P01106 1/20 0.38
POLB P06746 1/20 0.38
FGFR1 P11362 1/20 0.38
FGFR2 P21802 1/20 0.38
FGFR4 P22455 1/20 0.38
FGFR3 P22607 1/20 0.38
DPP4 P27487 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL21706492 0.89 CA1 (0.42) CA1CA2CA7CA9USP8
SCHEMBL24489439 0.78 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL29634210 0.77 CA1 (0.52) CA1CA2CA7CA9USP8
SCHEMBL1688847 0.77 ALDH1A1 (0.55) CA1CA2CA7CA9USP8
SCHEMBL4161497 0.77 CA1 (0.52) CA1CA2CA7CA9USP8
SCHEMBL12258322 0.74 ALDH1A1 (0.54) CA1CA2CA7CA9USP8
SCHEMBL19860962 0.73 DAO (0.43) CA1CA2CA7CA9DAO
SCHEMBL23095433 0.73 MAPT (0.54) ALDH1A1MEN1KMT2APOLBNPC1
SCHEMBL18557051 0.72 MYC (0.40) CA1CA2CA7CA9ALDH1A1
SCHEMBL6036681 0.72 TDP2 (0.52) CA1CA2CA7CA9USP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10950806-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2021-03-16 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 (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-10950806-B2 Organic electroluminescent compound and organic electroluminescent device comprising the same OR10J3, ORC3, ICOSLG CA1 3799/4885CA2 3370/4885CA7 3219/4885

“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.