SCHEMBL2955115

SCHEMBL2955115

c1ccc2c(-c3c4ccccc4c(-c4cccc5ccccc45)c4cc(-c5ccc6c(-c7cccc8ccccc78)c7ccccc7c(-c7cccc8ccccc78)c6c5)ccc34)cccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.45
CA1 P00915 4/20 0.45
CA2 P00918 4/20 0.45
CA9 Q16790 4/20 0.45
MCL1 Q07820 1/20 0.42
ACMSD Q8TDX5 1/20 0.42
SOS1 Q07889 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
DHFR P00374 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALPL P05186 1/20 0.41
GAA P10253 1/20 0.41
TYMP P19971 1/20 0.40
ALDH1A1 P00352 2/20 0.40
ATM Q13315 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL30744707 0.94 CA12 (0.49) CA12CA1CA2CA9MCL1
SCHEMBL12231078 0.94 CA12 (0.49) CA12CA1CA2CA9MCL1
SCHEMBL28360030 0.94 CA12 (0.49) CA12CA1CA2CA9MCL1
SCHEMBL22345775 0.94 MCL1 (0.49) CA12CA1CA2CA9MCL1
SCHEMBL29770904 0.94 MCL1 (0.49) CA12CA1CA2CA9MCL1
SCHEMBL23988465 0.90 CA12 (0.46) CA12CA1CA2CA9MCL1
SCHEMBL22993276 0.90 CA12 (0.42) CA12CA1CA2CA9MCL1
SCHEMBL15945273 0.90 CA12 (0.42) CA12CA1CA2CA9MCL1
SCHEMBL21710729 0.89 MCL1 (0.42) CA12CA1CA2CA9MCL1
SCHEMBL20433933 0.88 CA12 (0.51) CA12CA1CA2CA9MCL1

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-20100025661-A1 Luminescent material and organic electroluminescent device using the same JNC CORPORATION (JP) 2010-02-04 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-20100025661-A1 Luminescent material and organic electroluminescent device using the same TRPV3, TRPC3, HVCN1 CA12 3773/4885CA1 3258/4885CA2 1531/4885

“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.