SCHEMBL2607410

SCHEMBL2607410

Cc1cccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
NOTUM Q6P988 2/20 0.41
OPRD1 P41143 3/20 0.39
HSP90AA1 P07900 1/20 0.39
MGLL Q99685 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
HTR1D P28221 1/20 0.37
PGR P06401 1/20 0.37
RORA P35398 1/20 0.37
RORC P51449 1/20 0.37
RORB Q92753 1/20 0.37
ADRB1 P08588 1/20 0.37
KIF11 P52732 1/20 0.37
OPRM1 P35372 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL10206206 0.97 TDP1 (0.41) TDP1NOTUMOPRD1HSP90AA1MGLL
SCHEMBL24797315 0.94 TDP1 (0.39) TDP1NOTUMOPRD1HSP90AA1MGLL
SCHEMBL2604421 0.91 SERPINE1 (0.41) TDP1NOTUMOPRD1HSP90AA1MGLL
SCHEMBL31297416 0.90 NOTUM (0.42) TDP1NOTUMOPRD1L3MBTL1ALDH1A1
SCHEMBL63688 0.90 NOTUM (0.42) TDP1NOTUMOPRD1L3MBTL1ALDH1A1
SCHEMBL2604422 0.88 SERPINE1 (0.39) TDP1NOTUMOPRD1ALDH1A1OPRM1
SCHEMBL13021221 0.88 OPRD1 (0.38) TDP1NOTUMOPRD1ALDH1A1OPRM1
SCHEMBL25693139 0.88 ALDH1A1 (0.41) TDP1NOTUMOPRD1ALDH1A1HTR1D
SCHEMBL18525752 0.85 KDM4E (0.44) NOTUML3MBTL1ALDH1A1HPGDPGR
SCHEMBL8739889 0.85 KIF11 (0.42) NOTUMOPRD1ALDH1A1HTR1DPGR

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-11538998-B2 Organic compound, light emitting diode and light emitting device having the compound LG DISPLAY CO., LTD. (KR) 2022-12-27 US disclosed
US-9067942-B2 Pyrrolopyrrole derivatives, their manufacture and use as semiconductors BASF SE (DE) 2015-06-30 US disclosed
US-20120095236-A1 PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE AS SEMICONDUCTORS BASF SE (DE) 2012-04-19 US disclosed
US-20120095236-A1 PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE AS SEMICONDUCTORS BASF SE (DE) 2012-04-19 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-11538998-B2 Organic compound, light emitting diode and light emitting device having the compound BCL9L, L3MBTL4, LAGE3 TDP1 2155/4885NOTUM 1791/4885OPRD1 1172/4885
US-20120095236-A1 PYRROLOPYRROLE DERIVATIVES, THEIR MANUFACTURE AND USE AS SEMICONDUCTORS PPOX, PIN1, DDT TDP1 1236/4885NOTUM 2901/4885OPRD1 689/4885

“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.