SCHEMBL13701302

SCHEMBL13701302

O=Cc1ccc(-n2c3cc(Br)ccc3c3ccc(Br)cc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
TRIM24 O15164 1/20 0.38
TRIM33 Q9UPN9 1/20 0.38
KDM4E B2RXH2 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CYP2A6 P11509 2/20 0.37
ERN1 O75460 2/20 0.36
ALDH1A3 P47895 1/20 0.36
KCNJ1 P48048 1/20 0.35
MAPK1 P28482 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
PDGFRA P16234 1/20 0.33
CDK5 Q00535 1/20 0.33
TYRO3 Q06418 1/20 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
SCHEMBL29392880 0.86 ALDH1A1 (0.40) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL13158817 0.86 ALDH1A1 (0.40) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL17515011 0.83 ALDH1A1 (0.42) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL28317572 0.83 TSHR (0.38) ALDH1A1KDM4ECYP2A6MAPK1CA12
SCHEMBL17512995 0.83 ALDH1A1 (0.46) ALDH1A1KDM4E
SCHEMBL13701303 0.83 ALDH1A1 (0.38) ALDH1A1KDM4ECA12CA1CA2
SCHEMBL23865614 0.80 ALDH1A1 (0.35) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL13158505 0.79 CYP2A6 (0.50) ALDH1A1TRIM24TRIM33KDM4ESMN1; SMN2
SCHEMBL24753547 0.79 CYP2A6 (0.42) ALDH1A1TRIM24TRIM33KDM4ECYP2A6
SCHEMBL28581392 0.77 L3MBTL1 (0.57) ALDH1A1KDM4ECYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112175171-B Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 苏州希夫安材料科技有限公司 2022-07-05 CN claimed
CN-112175171-A Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 南京优写智能科技有限公司 2021-01-05 CN claimed
CN-112175171-B Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 苏州希夫安材料科技有限公司 2022-07-05 CN disclosed
CN-112175171-B Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 苏州希夫安材料科技有限公司 2022-07-05 CN disclosed
CN-112175171-A Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 南京优写智能科技有限公司 2021-01-05 CN disclosed
CN-112175171-A Novel donor-acceptor polymer functionalized photoacoustic developer and preparation method thereof 南京优写智能科技有限公司 2021-01-05 CN disclosed
CN-104045818-B A kind of containing allene contracting thiourea-carbazole-benzo two thiophene copolymers and preparation method and application 海洋王照明科技股份有限公司 2016-08-24 CN disclosed
US-20090227765-A1 Monomer for making a crosslinked polymer CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2009-09-10 US disclosed
US-20090227765-A1 Monomer for making a crosslinked polymer CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2009-09-10 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-20090227765-A1 Monomer for making a crosslinked polymer AR, RAD51, RAD1 ALDH1A1 619/4885TRIM24 596/4885TRIM33 607/4885

“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.