SCHEMBL31428656

SCHEMBL31428656

COc1cc(C=C2C(=O)c3ccccc3N2C(C)=O)ccc1NC(=O)CN1CCOCC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ MAPK1 P28482 5/20 0.51
▸ KMT2A Q03164 4/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ PKM P14618 1/20 0.51
▸ PIK3CA P42336 1/20 0.49
▸ PRKDC P78527 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.48
▸ USP2 O75604 2/20 0.48
▸ LMNA P02545 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ HRH3 Q9Y5N1 1/20 0.46
▸ HTT P42858 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ TSHR P16473 1/20 0.45

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
SCHEMBL31428485 0.82 LRRK2 (0.52) MAPTSMN1; SMN2MAPK1KMT2AALDH1A1
SCHEMBL30163514 0.78 ALDH1A1 (0.60) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL30163481 0.78 KMT2A (0.68) MAPTSMN1; SMN2ALOX15MAPK1KMT2A
SCHEMBL31428848 0.75 MAPT (0.60) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL31428936 0.74 ALDH1A1 (0.59) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL30163499 0.73 MAPT (0.56) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL1643927 0.73 ALDH1A1 (0.76) MAPTSMN1; SMN2ALOX15MAPK1KMT2A
SCHEMBL31429081 0.72 MAPT (0.53) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL30163547 0.72 ALDH1A1 (0.53) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL31428731 0.72 MAPT (0.55) MAPTSMN1; SMN2MAPK1KMT2AMEN1

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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2025-03-20 — — 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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND BRAF, RAF1, NRAS MAPT 4513/4885SMN1; SMN2 4832/4885ALOX15 4555/4885

“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.

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