SCHEMBL26324134

SCHEMBL26324134

O=C(OCCCC1CCO1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.60
LMNA P02545 1/20 0.49
SCN1A P35498 1/20 0.48
SCN2A Q99250 1/20 0.48
SCN3A Q9NY46 1/20 0.48
BCHE P06276 2/20 0.45
ALDH1A1 P00352 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
MAPK1 P28482 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL9844172 0.88 TDP1 (0.64) TDP1LMNASCN1ASCN2ASCN3A
SCHEMBL12487561 0.84 HPGD (0.55) TDP1LMNAALDH1A1L3MBTL1HPGD
SCHEMBL28036335 0.82 TDP1 (0.56) TDP1LMNASCN1ASCN2ASCN3A
SCHEMBL6662971 0.82 TDP1 (0.65) TDP1LMNASCN1ASCN2ASCN3A
SCHEMBL12959086 0.81 NPC1 (0.53) TDP1LMNAMEN1KMT2AMAPK1
SCHEMBL10857542 0.79 HPGD (0.44) TDP1SCN1ASCN2ASCN3AALDH1A1
SCHEMBL27898323 0.78 TDP1 (0.58) TDP1LMNASCN1ASCN2ASCN3A
SCHEMBL21820641 0.77 TDP1 (0.71) TDP1LMNASCN1ASCN2ASCN3A
SCHEMBL223441 0.77 TDP1 (1.00) TDP1LMNAALDH1A1KMT2AMAPK1
SCHEMBL416566 0.77 TDP1 (0.91) TDP1LMNAALDH1A1KMT2AMAPK1

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-20230278955-A1 VITAMIN D3 DERIVATIVES AND PHARMACEUTICAL USE THEREOF UNIV KYOTO (JP) 2023-09-07 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-20230278955-A1 VITAMIN D3 DERIVATIVES AND PHARMACEUTICAL USE THEREOF VDR, CYP24A1, CYP2R1 TDP1 4802/4885LMNA 3022/4885SCN1A 4399/4885

“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.