SCHEMBL23913688

SCHEMBL23913688

Brc1cccc(S(c2ccccc2)(c2ccccc2)c2cccc(Br)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 1/20 0.46
MMP2 P08253 2/20 0.45
PGR P06401 1/20 0.44
BRD4 O60885 1/20 0.42
ATM Q13315 1/20 0.42
MAPK1 P28482 1/20 0.41
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAOB P27338 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KAT6A Q92794 2/20 0.37
IDO1 P14902 1/20 0.37

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
SCHEMBL21766576 1.00 ALDH1A1 (0.46) ALDH1A1TDP1MMP2PGRBRD4
SCHEMBL25625457 0.90 ALDH1A1 (0.46) ALDH1A1TDP1MMP2PGRBRD4
SCHEMBL23597859 0.82 CA1 (0.43) ALDH1A1TDP1MMP2TSHRSMN1; SMN2
SCHEMBL22781012 0.78 NPC1 (0.44) ALDH1A1MMP2PGRMAPK1MEN1
SCHEMBL3831593 0.77 HTR6 (0.61) ALDH1A1MMP2PGRBRD4ATM
SCHEMBL23914033 0.77 ALDH1A1 (0.43) ALDH1A1TDP1MMP2PGRBRD4
SCHEMBL29945255 0.77 HTR6 (0.61) ALDH1A1MMP2PGRBRD4ATM
SCHEMBL21766545 0.77 ALDH1A1 (0.53) ALDH1A1TDP1MMP2MAPK1EGFR
SCHEMBL19850353 0.77 ALDH1A1 (0.53) ALDH1A1TDP1MMP2MAPK1EGFR
SCHEMBL3259521 0.76 HTR6 (0.53) ALDH1A1TDP1MMP2MEN1KMT2A

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-20230257401-A1 LIGHT EMITTING DEVICE AND NITROGEN-CONTAINING COMPOUND FOR LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-17 US disclosed
US-20210317147-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME LG CHEM, LTD. (KR) 2021-10-14 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-20210317147-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING SAME CYP1A1, CRY1, CYP1B1 ALDH1A1 23/4885TDP1 2065/4885MMP2 4856/4885
US-20230257401-A1 LIGHT EMITTING DEVICE AND NITROGEN-CONTAINING COMPOUND FOR LIGHT EMITTING DEVICE CRY1, CRY2, NOTCH1 ALDH1A1 44/4885TDP1 1961/4885MMP2 4719/4885

“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.