SCHEMBL12031457

SCHEMBL12031457

O=C1c2ccccc2-c2ccc3c4ccc5c6c(ccc(c7ccc1c2c73)c64)-c1ccccc1-5

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 2/20 0.60
▸ CYP3A4 P08684 3/20 0.59
▸ DNMT1 P26358 3/20 0.59
▸ PABPC1 P11940 2/20 0.59
▸ CASP1 P29466 1/20 0.59
▸ CASP7 P55210 1/20 0.59
▸ SMN1; SMN2 Q16637 4/20 0.58
▸ KDM4E B2RXH2 2/20 0.58
▸ MAPT P10636 2/20 0.58
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ CDC25B P30305 1/20 0.55
▸ CYP1A2 P05177 4/20 0.53
▸ HIF1A Q16665 2/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ S100A4 P26447 4/20 0.52
▸ PTPRC P08575 4/20 0.52
▸ MAPK1 P28482 3/20 0.52
▸ NPC1 O15118 3/20 0.52
▸ RAB9A P51151 3/20 0.52

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
SCHEMBL29354334 1.00 BCL2 (0.60) BCL2CYP3A4DNMT1PABPC1CASP1
SCHEMBL12449237 1.00 BCL2 (0.60) BCL2CYP3A4DNMT1PABPC1CASP1
SCHEMBL29356917 1.00 BCL2 (0.60) BCL2CYP3A4DNMT1PABPC1CASP1
Anthraquinone SCHEMBL4307959 1.00 BCL2 (0.60) BCL2CYP3A4DNMT1PABPC1CASP1
SCHEMBL79475 1.00 BCL2 (0.60) BCL2CYP3A4DNMT1PABPC1CASP1
SCHEMBL88058 1.00 BCL2 (0.60) BCL2CYP3A4DNMT1PABPC1CASP1
Bromide SCHEMBL28387245 0.98 BCL2 (0.58) BCL2CYP3A4DNMT1PABPC1CASP1
SCHEMBL31500774 0.91 DNMT1 (0.70) BCL2CYP3A4DNMT1PABPC1CASP1
SCHEMBL31500772 0.91 DNMT1 (0.70) BCL2CYP3A4DNMT1PABPC1CASP1
SCHEMBL43327 0.91 DNMT1 (0.70) BCL2CYP3A4DNMT1PABPC1CASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110308592-A1 USE OF SUBSTITUTED PERYLENES IN ORGANIC SOLAR CELLS BASF SE (DE) 2011-12-22 — — US disclosed
WO-2011158211-A1 USE OF SUBSTITUTED PERYLENES IN ORGANIC SOLAR CELLS BASF SE (DE) 2011-12-22 — — WO disclosed
US-20110308592-A1 USE OF SUBSTITUTED PERYLENES IN ORGANIC SOLAR CELLS BASF SE (DE) 2011-12-22 — — 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-20110308592-A1 USE OF SUBSTITUTED PERYLENES IN ORGANIC SOLAR CELLS PPOX, JUP, CRY2 BCL2 3019/4885CYP3A4 1478/4885DNMT1 505/4885

“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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