SCHEMBL19685952

SCHEMBL19685952

Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cc(C)ccc1N2c1ccc2c(=O)cc(C)oc2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
GAA P10253 1/20 0.34
ACHE P22303 1/20 0.34
TP53 P04637 3/20 0.33
MAPT P10636 3/20 0.33
KDM4E B2RXH2 2/20 0.33
CYP3A4 P08684 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP1A1 P04798 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP1B1 Q16678 2/20 0.33
POLB P06746 2/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAOB P27338 2/20 0.32
TNKS O95271 1/20 0.32
PARP1 P09874 1/20 0.32

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
SCHEMBL19685953 0.93 ACHE (0.40) ALDH1A1HPGDACHETP53MAPT
SCHEMBL19685788 0.92 ACHE (0.37) ALDH1A1GAAACHETP53MAPT
SCHEMBL19685692 0.90 MAOB (0.37) ACHECYP1A1CYP1A2CYP1B1MAOB
SCHEMBL19685951 0.90 ALDH1A1 (0.36) ALDH1A1HPGDGAAACHETP53
SCHEMBL19685882 0.86 POLB (0.36) ALDH1A1HPGDGAAACHETP53
SCHEMBL17752284 0.86 MAOA (0.39) ALDH1A1HPGDTP53MAPTKDM4E
SCHEMBL19685954 0.84 ACHE (0.43) ALDH1A1HPGDGAAACHETP53
SCHEMBL19685955 0.83 ACHE (0.40) ALDH1A1HPGDACHETP53MAPT
SCHEMBL19685972 0.83 ACHE (0.38) ALDH1A1HPGDACHETP53MAPT
SCHEMBL19685676 0.81 ALDH1A1 (0.33) ALDH1A1HPGDTP53MAPTKDM4E

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-20230101042-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES U.S. DEPARTMENT OF ENERGY 2023-03-30 US disclosed
US-10714693-B2 Polycyclic compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-07-14 US disclosed
US-20170352817-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2017-12-07 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 (3 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-10714693-B2 Polycyclic compound and organic electroluminescence device including the same CYC1, CCNA1, CYCS ALDH1A1 572/4885HPGD 901/4885GAA 4777/4885
US-20230101042-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, AOC2 ALDH1A1 28/4885HPGD 497/4885GAA 1322/4885
US-20170352817-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME CYC1, CCNA1, CYCS ALDH1A1 572/4885HPGD 901/4885GAA 4777/4885

“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.