SCHEMBL31428655

SCHEMBL31428655

O=C(COc1cccnc1F)N1CCOCC1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 7/20 0.70
L3MBTL1 Q9Y468 2/20 0.52
TSHR P16473 1/20 0.52
USP2 O75604 1/20 0.52
POLB P06746 1/20 0.51
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 3/20 0.49
KEAP1 Q14145 1/20 0.49
NFE2L2 Q16236 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPT P10636 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL1101337 0.82 KDM4E (0.68) FKBP1AL3MBTL1TSHRUSP2POLB
SCHEMBL31428561 0.78 FKBP1A (0.57) FKBP1AL3MBTL1TSHRUSP2POLB
SCHEMBL12988518 0.77 FKBP1A (0.71) FKBP1AL3MBTL1TSHRPOLBALDH1A1
SCHEMBL12169303 0.76 FKBP1A (0.69) FKBP1AL3MBTL1TSHRPOLBALDH1A1
SCHEMBL31428775 0.76 FKBP1A (0.69) FKBP1AL3MBTL1TSHRUSP2POLB
SCHEMBL6631915 0.76 FKBP1A (0.69) FKBP1AL3MBTL1TSHRPOLBALDH1A1
SCHEMBL13917218 0.75 FKBP1A (0.64) FKBP1AL3MBTL1TSHRPOLBALDH1A1
SCHEMBL31428914 0.75 FKBP1A (0.61) FKBP1AUSP2POLBALDH1A1KDM4E
SCHEMBL7316803 0.75 FKBP1A (0.67) FKBP1AL3MBTL1TSHRPOLBALDH1A1
SCHEMBL12015661 0.74 FKBP1A (0.66) FKBP1AL3MBTL1TSHRUSP2POLB

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 FKBP1A 2064/4885L3MBTL1 1560/4885TSHR 1389/4885

“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.