SCHEMBL13567140

SCHEMBL13567140

CCCCCCCCn1c(=O)c2cc3c(=O)oc(=O)c3cc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.43
▸ ADORA2B P29275 1/20 0.42
▸ FAAH O00519 2/20 0.41
▸ RORA P35398 3/20 0.41
▸ RORC P51449 3/20 0.41
▸ RORB Q92753 3/20 0.41
▸ PTGS1 P23219 3/20 0.41
▸ PTGS2 P35354 3/20 0.41
▸ MGLL Q99685 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ PGR P06401 2/20 0.41
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ BCHE P06276 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
SCHEMBL12659781 0.92 TDP1 (0.45) TDP1L3MBTL1ALDH1A1ADORA2BFAAH
SCHEMBL10556725 0.89 TDP1 (0.58) TDP1L3MBTL1ALDH1A1ADORA2BFAAH
SCHEMBL10554618 0.89 TDP1 (0.58) TDP1L3MBTL1ALDH1A1ADORA2BFAAH
SCHEMBL18211042 0.88 TDP1 (0.56) TDP1L3MBTL1ALDH1A1ADORA2BFAAH
SCHEMBL18211041 0.88 TDP1 (0.56) TDP1L3MBTL1ALDH1A1ADORA2BFAAH
SCHEMBL25473109 0.84 TDP1 (0.53) TDP1L3MBTL1ALDH1A1ADORA2BFAAH
SCHEMBL13744749 0.84 TDP1 (0.53) TDP1L3MBTL1ALDH1A1ADORA2BFAAH
SCHEMBL12246385 0.84 TDP1 (0.53) TDP1L3MBTL1ALDH1A1ADORA2BFAAH
SCHEMBL8777494 0.82 TDP1 (0.68) TDP1L3MBTL1ALDH1A1RORARORC
SCHEMBL17798767 0.81 TDP1 (0.50) TDP1L3MBTL1ALDH1A1MAPTMEN1

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-9039946-B2 Reversibly thermochromic compositions BASF SE (DE) 2015-05-26 — — US disclosed
US-9039946-B2 Reversibly thermochromic compositions BASF SE (DE) 2015-05-26 — — US disclosed
US-20090302284-A1 Reversibly Thermochromic Compositions CIBA CORPORATION 2009-12-10 — — US disclosed
US-20090302284-A1 Reversibly Thermochromic Compositions CIBA CORPORATION 2009-12-10 — — 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-20090302284-A1 Reversibly Thermochromic Compositions DHCR7, NES, DUT TDP1 827/4885L3MBTL1 4265/4885ALDH1A1 775/4885

“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.

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