SCHEMBL21179294

SCHEMBL21179294

c1ccc(Oc2ccc3cccc4c5c(Oc6ccccc6)ccc6cccc(c2c34)c65)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 3/20 0.50
HSD17B10 Q99714 2/20 0.50
THRB P10828 1/20 0.50
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
ERBB2 P04626 1/20 0.41
FYN P06241 1/20 0.41
MAOA P21397 1/20 0.41
ACHE P22303 1/20 0.41
AHR P35869 1/20 0.41
GLA P06280 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 2/20 0.41
LTA4H P09960 1/20 0.41
KCNA3 P22001 1/20 0.40
CYP3A4 P08684 2/20 0.37
CYP1A1 P04798 1/20 0.37
CYP1B1 Q16678 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
SCHEMBL6516074 0.96 CYP1A2 (0.52) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL443084 0.85 CYP1A2 (0.46) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL16574516 0.82 LTA4H (0.46) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL4564700 0.82 ALDH1A1 (0.56) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL29568013 0.81 LTA4H (0.50) CYP1A2ALDH1A1HPGDMAPTKDM4E
SCHEMBL29613395 0.79 KMT2A (0.41) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL3618861 0.79 KMT2A (0.41) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL28554537 0.78 CYP1A2 (0.43) CYP1A2ALDH1A1HPGDHSD17B10THRB
SCHEMBL25969601 0.78 MAPT (0.61) CYP1A2ALDH1A1HSD17B10MAPTKDM4E
SCHEMBL29613394 0.76 CYP1A2 (0.42) CYP1A2ALDH1A1HPGDHSD17B10THRB

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-11912720-B2 Rigid chiral photoluminescent isosceles triangular materials NORTHWESTERN UNIVERSITY (US) 2024-02-27 US disclosed
US-20210122767-A1 RIGID CHIRAL PHOTOLUMINESCENT ISOSCELES TRIANGULAR MATERIALS NORTHWESTERN UNIVERSITY (US) 2021-04-29 US disclosed
WO-2019144074-A1 RIGID CHIRAL PHOTOLUMINESCENT ISOSCELES TRIANGULAR MATERIALS NORTHWESTERN UNIVERSITY (US) 2019-07-25 WO 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-20210122767-A1 RIGID CHIRAL PHOTOLUMINESCENT ISOSCELES TRIANGULAR MATERIALS PPIE, PARN, PIN1 CYP1A2 3972/4885ALDH1A1 1708/4885HPGD 251/4885
US-11912720-B2 Rigid chiral photoluminescent isosceles triangular materials PPIE, PARN, PIN1 CYP1A2 3972/4885ALDH1A1 1708/4885HPGD 251/4885

“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.