SCHEMBL30152286

SCHEMBL30152286

O=C1Nc2cc([N+](=O)[O-])ccc2OC1c1cccc(F)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.48
ALDH1A1 P00352 6/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PGR P06401 5/20 0.40
NR3C1 P04150 2/20 0.40
AR P10275 2/20 0.40
KDM4E B2RXH2 2/20 0.39
KMT2A Q03164 7/20 0.39
MEN1 O00255 6/20 0.39
MAPT P10636 5/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 2/20 0.38
IDO1 P14902 1/20 0.36

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
SCHEMBL30943180 0.78 KMT2A (0.53) BRD4ALDH1A1CYP1A2CYP3A4ALOX15
SCHEMBL17434178 0.78 KMT2A (0.53) BRD4ALDH1A1CYP1A2CYP3A4ALOX15
SCHEMBL30152376 0.77 MEN1 (0.42) ALDH1A1CYP1A2CYP3A4ALOX15HSD17B10
SCHEMBL3590372 0.73 PARP1 (0.54) ALDH1A1CYP1A2CYP3A4ALOX15HSD17B10
SCHEMBL2100537 0.73 PARP1 (0.54) ALDH1A1CYP1A2CYP3A4ALOX15HSD17B10
SCHEMBL2101407 0.73 PARP1 (0.54) ALDH1A1CYP1A2CYP3A4ALOX15HSD17B10
SCHEMBL190001 0.73 KMT2A (0.46) ALDH1A1CYP1A2CYP3A4ALOX15HSD17B10
SCHEMBL11040723 0.72 CA2 (0.64) BRD4PGRNR3C1ARKDM4E
SCHEMBL4968968 0.70 BRD4 (0.48) BRD4ALDH1A1CYP1A2CYP3A4ALOX15
SCHEMBL6997454 0.70 KMT2A (0.55) ALDH1A1CYP1A2CYP3A4ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230115350-A1 TEAD INHIBITORS AND USES THEREOF CEDILLA THERAPEUTICS, INC. 2023-04-13 US disclosed
WO-2023009785-A1 TEAD INHIBITORS AND USES THEREOF CEDILLA THERAPEUTICS, INC. (US) 2023-02-02 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 (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-20230115350-A1 TEAD INHIBITORS AND USES THEREOF TEAD2, TEAD3, TEAD4 BRD4 988/4885ALDH1A1 1319/4885CYP1A2 1435/4885

“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.