SCHEMBL8771469

SCHEMBL8771469

Cc1ccc(Cc2ccc(Cc3ccc(N)cc3)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.74
ALDH1A1 P00352 2/20 0.74
TDP1 Q9NUW8 2/20 0.74
TSHR P16473 1/20 0.74
ACHE P22303 1/20 0.68
CYP1A2 P05177 2/20 0.54
CYP2A6 P11509 1/20 0.54
TAAR1 Q96RJ0 1/20 0.54
TEAD4 Q15561 1/20 0.52
POLB P06746 2/20 0.50
MAPT P10636 1/20 0.50
GFER P55789 1/20 0.50
CYP17A1 P05093 1/20 0.50
CYP19A1 P11511 1/20 0.50
CYP11B1 P15538 1/20 0.50
CYP11B2 P19099 1/20 0.50
LTA4H P09960 1/20 0.48
LOXL2 Q9Y4K0 1/20 0.48
NPC1 O15118 1/20 0.47
USP2 O75604 1/20 0.47

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
SCHEMBL2923178 1.00 CYP3A4 (0.74) CYP3A4ALDH1A1TDP1TSHRACHE
SCHEMBL21755725 0.93 CYP3A4 (0.64) CYP3A4ALDH1A1TDP1TSHRACHE
4,4'-Methylenedianiline SCHEMBL6567022 0.88 TSHR (0.64) CYP3A4ALDH1A1TDP1TSHRACHE
SCHEMBL13139577 0.87 TEAD4 (0.76) CYP3A4ALDH1A1TDP1TSHRACHE
SCHEMBL19987393 0.87 ALDH1A1 (0.56) CYP3A4ALDH1A1TDP1TSHRACHE
SCHEMBL1149394 0.86 IDO1 (0.58) CYP3A4ALDH1A1TDP1TSHRACHE
SCHEMBL11410252 0.86 IDO1 (0.58) CYP3A4ALDH1A1TDP1TSHRACHE
SCHEMBL1304762 0.86 CYP3A4 (1.00) CYP3A4ALDH1A1TDP1TSHRMAPT
SCHEMBL8094139 0.86 CYP3A4 (1.00) CYP3A4ALDH1A1TDP1TSHRMAPT
SCHEMBL6362775 0.86 CYP3A4 (1.00) CYP3A4ALDH1A1TDP1TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312812-A1 EPOXY RESIN THE BOEING COMPANY 2023-10-05 US disclosed
US-11718707-B2 Epoxy resin THE BOEING COMPANY (US) 2023-08-08 US disclosed
US-8529801-B2 Negative active material for rechargeable lithium battery, and negative electrode for rechargeable lithium battery, and rechargeable lithium battery including same SAMSUNG SDI CO., LTD. (KR) 2013-09-10 US disclosed
US-20090087748-A1 NEGATIVE ACTIVE MATERIAL FOR RECHARGEABLE LITHIUM BATTERY, AND NEGATIVE ELECTRODE FOR RECHARGEABLE LITHIUM BATTERY, AND RECHARGEABLE LITHIUM BATTERY INCLUDING SAME SAMSUNG SDI CO., LTD. (KR) 2009-04-02 US disclosed
CN-1173886-A Polyamic acid, polyimide film and liquid crystal aligning film and liquid crystal display element CHISSO CORP (JP) 1998-02-18 CN disclosed
EP-0799270-A1 POLYAMIC ACID, POLYIMIDE FILM AND LIQUID CRYSTAL ALIGNING FILM AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1997-10-08 EP disclosed
WO-1997014742-A1 POLYAMIC ACID, POLYIMIDE FILM AND LIQUID CRYSTAL ALIGNING FILM AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1997-04-24 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-11718707-B2 Epoxy resin EPHX2, EPHX1, CBR1 CYP3A4 974/4885ALDH1A1 636/4885TDP1 1396/4885
US-20230312812-A1 EPOXY RESIN EPHX2, EPHX1, CBR1 CYP3A4 974/4885ALDH1A1 636/4885TDP1 1396/4885

“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.