SCHEMBL25922244

SCHEMBL25922244

O=C1COc2ccc(C(=O)Nc3ccc(CNc4ccccc4)cc3)cc2N1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.71
ALDH1A1 P00352 2/20 0.58
MAPT P10636 2/20 0.58
POLB P06746 1/20 0.58
KMT2A Q03164 1/20 0.57
TSHR P16473 1/20 0.57
CYP1A2 P05177 4/20 0.56
CYP3A4 P08684 4/20 0.56
CYP19A1 P11511 4/20 0.56
CYP2C9 P11712 2/20 0.56
CYP2C19 P33261 2/20 0.56
CYP2D6 P10635 1/20 0.56
TRPV1 Q8NER1 2/20 0.54
GAA P10253 2/20 0.53
MAOA P21397 1/20 0.51

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
SCHEMBL30270577 1.00 PARP1 (0.71) PARP1ALDH1A1MAPTPOLBKMT2A
SCHEMBL531752 0.89 ALDH1A1 (0.67) PARP1ALDH1A1MAPTPOLBKMT2A
SCHEMBL24124197 0.84 ALDH1A1 (0.64) PARP1ALDH1A1MAPTPOLBKMT2A
SCHEMBL24124992 0.84 ALDH1A1 (0.54) PARP1ALDH1A1MAPTPOLBKMT2A
SCHEMBL531858 0.83 PARP1 (1.00) PARP1MAPTKMT2ATSHRCYP1A2
SCHEMBL24124997 0.82 ALDH1A1 (0.59) PARP1ALDH1A1MAPTPOLBKMT2A
SCHEMBL8192718 0.82 ALDH1A1 (0.77) ALDH1A1MAPTPOLBKMT2ATSHR
SCHEMBL24124625 0.82 ALDH1A1 (0.56) PARP1ALDH1A1MAPTPOLBKMT2A
SCHEMBL531798 0.82 TSHR (0.74) PARP1ALDH1A1MAPTTSHRGAA
SCHEMBL24125259 0.81 RAB9A (0.46) PARP1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242496-A1 SOX11 INHIBITORS FOR TREATING MANTLE CELL LYMPHOMA ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2023-08-03 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 (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-20230242496-A1 SOX11 INHIBITORS FOR TREATING MANTLE CELL LYMPHOMA BCL6, SOX18, BCL3 PARP1 1599/4885ALDH1A1 2654/4885MAPT 4492/4885

“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.