SCHEMBL26014228

SCHEMBL26014228

CC1(C)c2ccccc2-c2cc(-c3ccccc3[N+](=O)[O-])cc(Cl)c21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
TDP1 Q9NUW8 3/20 0.45
HSD11B1 P28845 1/20 0.39
GSK3B P49841 3/20 0.37
PGR P06401 2/20 0.37
GSK3A P49840 2/20 0.37
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 1/20 0.35
GMNN O75496 1/20 0.35
CCNB2 O95067 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CDK1 P06493 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL26014223 0.84 ALDH1A1 (0.44) ALDH1A1TDP1HSD11B1GSK3BPGR
SCHEMBL20175733 0.80 ALDH1A1 (0.51) ALDH1A1TDP1MAPTNPC1CASP3
SCHEMBL26014281 0.78 S100A4 (0.40) ALDH1A1TDP1HSD11B1GSK3BGSK3A
SCHEMBL19421336 0.77 TDP1 (0.46) ALDH1A1TDP1MAPTHSD17B10LMNA
SCHEMBL31617 0.77 ALDH1A1 (0.51) ALDH1A1TDP1HSD11B1PGRMAPT
SCHEMBL26014226 0.76 HSD11B1 (0.43) ALDH1A1TDP1HSD11B1GSK3BPGR
SCHEMBL26014225 0.75 ALDH1A1 (0.46) ALDH1A1TDP1HSD11B1GSK3BMAPT
SCHEMBL13002118 0.75 ALDH1A1 (0.47) ALDH1A1TDP1MAPTHSD17B10CYP1A2
SCHEMBL24730947 0.75 HSD11B1 (0.46) ALDH1A1TDP1HSD11B1GSK3BMAPT
SCHEMBL18553670 0.74 ALDH1A1 (0.42) ALDH1A1TDP1HSD11B1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230301184-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS THEREOF SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-09-21 US disclosed
US-20230301184-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS THEREOF SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-09-21 US disclosed
US-20230257387-A1 ORGANIC COMPOUND, ELECTRONIC ELEMENT AND ELECTRONIC DEVICE THEREOF SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-08-17 US disclosed
US-20230257387-A1 ORGANIC COMPOUND, ELECTRONIC ELEMENT AND ELECTRONIC DEVICE THEREOF SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-08-17 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-20230301184-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS THEREOF OCIAD1, OCIAD2, OSTC ALDH1A1 641/4885TDP1 3544/4885HSD11B1 1095/4885
US-20230257387-A1 ORGANIC COMPOUND, ELECTRONIC ELEMENT AND ELECTRONIC DEVICE THEREOF OCIAD1, OCIAD2, EPCAM ALDH1A1 657/4885TDP1 2811/4885HSD11B1 2816/4885

“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.