SCHEMBL12510312

SCHEMBL12510312

CCC(C)N(c1ccc(N2CCCc3cc(/C=C/C=C4\C(=O)N(c5ccccc5)N=C4C(=O)O)ccc32)cc1)C(C)CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.40
MAPT P10636 10/20 0.40
MEN1 O00255 9/20 0.40
MAPK1 P28482 7/20 0.40
L3MBTL1 Q9Y468 5/20 0.40
TDP1 Q9NUW8 4/20 0.40
OPRK1 P41145 4/20 0.40
HTT P42858 3/20 0.40
LMNA P02545 2/20 0.40
PKM P14618 1/20 0.40
ALDH1A1 P00352 9/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MDM2 Q00987 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39
HPGD P15428 1/20 0.37
POLB P06746 3/20 0.36
TDP2 O95551 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 2/20 0.33
THRB P10828 2/20 0.33

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
SCHEMBL12428228 0.90 MAPT (0.42) KMT2AMAPTMEN1MAPK1L3MBTL1
SCHEMBL12428256 0.89 MAPT (0.52) KMT2AMAPTMEN1MAPK1L3MBTL1
SCHEMBL12428250 0.89 TDP2 (0.42) KMT2AMAPTMEN1MAPK1L3MBTL1
SCHEMBL12428197 0.87 KMT2A (0.48) KMT2AMAPTMEN1MAPK1L3MBTL1
SCHEMBL12428361 0.85 KMT2A (0.40) KMT2AMAPTMEN1MAPK1L3MBTL1
SCHEMBL12428236 0.85 MAPT (0.46) KMT2AMAPTMEN1MAPK1L3MBTL1
SCHEMBL12428196 0.85 ADRB2 (0.40) KMT2AMAPTMEN1MAPK1L3MBTL1
SCHEMBL12428331 0.85 KMT2A (0.47) KMT2AMAPTMEN1MAPK1L3MBTL1
SCHEMBL14289165 0.85 MAPT (0.42) KMT2AMAPTMEN1MAPK1L3MBTL1
SCHEMBL12428287 0.84 KMT2A (0.40) KMT2AMAPTMEN1MAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977570-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-07-12 US disclosed
US-20090084441-A1 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-04-02 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-20090084441-A1 Dye-sensitized photoelectric conversion device CRY1, H1-5, H1-0 KMT2A 105/4885MAPT 4642/4885MEN1 251/4885

“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.