SCHEMBL31290735

SCHEMBL31290735

c1ccc(C2=C3C(=C(c4ccccc4)C(c4ccccc4)=C3c3ccccc3)C(c3ccccc3)=C2c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.61
MAPK1 P28482 2/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
PDE4B Q07343 1/20 0.43
HSD17B10 Q99714 2/20 0.42
BCL2L1 Q07817 2/20 0.42
CYP1A2 P05177 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
CYP3A4 P08684 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NOTUM Q6P988 1/20 0.42
MMP3 P08254 1/20 0.42
KMT2A Q03164 2/20 0.42
BACE1 P56817 1/20 0.40
MEN1 O00255 1/20 0.40
P2RX7 Q99572 1/20 0.39

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
SCHEMBL532969 0.96 ALDH1A1 (0.67) ALDH1A1MAPK1RAB9ANPC1PDE4B
SCHEMBL852224 0.96 ALDH1A1 (0.67) ALDH1A1MAPK1RAB9ANPC1PDE4B
SCHEMBL532970 0.96 ALDH1A1 (0.67) ALDH1A1MAPK1RAB9ANPC1PDE4B
SCHEMBL8980173 0.92 ALDH1A1 (0.61) ALDH1A1MAPK1RAB9ANPC1PDE4B
SCHEMBL8440556 0.92 ALDH1A1 (0.61) ALDH1A1MAPK1RAB9ANPC1PDE4B
SCHEMBL4437887 0.82 ALDH1A1 (0.50) ALDH1A1MAPK1RAB9ANPC1PDE4B
SCHEMBL6414357 0.82 ALDH1A1 (0.50) ALDH1A1MAPK1RAB9ANPC1PDE4B
SCHEMBL4936702 0.82 ALDH1A1 (0.50) ALDH1A1MAPK1RAB9ANPC1PDE4B
SCHEMBL15334338 0.82 ALDH1A1 (0.42) ALDH1A1MAPK1RAB9ANPC1PDE4B
SCHEMBL3506393 0.82 ALDH1A1 (0.42) ALDH1A1MAPK1RAB9ANPC1PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240415014-A1 ORGANIC MOLECULE LIGHT EMITTERS THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2024-12-12 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-20240415014-A1 ORGANIC MOLECULE LIGHT EMITTERS CCND3, CCND2, OPRD1 ALDH1A1 603/4885MAPK1 4175/4885RAB9A 957/4885

“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.