SCHEMBL22104656

SCHEMBL22104656

COCCC(=O)Nc1cccc(-c2ccc(S(=O)(=O)Nc3ccc4c(c3)N(C(=O)C3CC3)CCC4)cc2)c1

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OGG1 O15527 6/20 0.78
TP53 P04637 6/20 0.53
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.51
EIF2AK2 P19525 1/20 0.47
NLRP3 Q96P20 1/20 0.47
MAPT P10636 2/20 0.46
LMNA P02545 2/20 0.46
THRB P10828 1/20 0.46
NR3C1 P04150 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TDP1 Q9NUW8 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
SCHEMBL22104672 0.88 OGG1 (1.00) OGG1TP53RAB9ANPC1EIF2AK2
SCHEMBL22104652 0.85 OGG1 (0.83) OGG1TP53RAB9ANPC1EIF2AK2
SCHEMBL22104650 0.84 OGG1 (0.82) OGG1TP53RAB9ANPC1EIF2AK2
SCHEMBL22104653 0.84 OGG1 (0.76) OGG1TP53RAB9AEIF2AK2NLRP3
SCHEMBL22104654 0.84 OGG1 (0.81) OGG1TP53RAB9ANPC1EIF2AK2
SCHEMBL22104655 0.84 OGG1 (0.81) OGG1TP53RAB9AEIF2AK2NLRP3
SCHEMBL22104700 0.83 OGG1 (0.83) OGG1TP53RAB9ANPC1EIF2AK2
SCHEMBL22104952 0.82 OGG1 (0.87) OGG1TP53RAB9ANPC1EIF2AK2
SCHEMBL22104673 0.82 OGG1 (0.81) OGG1TP53RAB9ANPC1EIF2AK2
SCHEMBL22104708 0.81 OGG1 (0.77) OGG1TP53NLRP3MAPTLMNA

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-20200190034-A1 Inhibitors of Base Excision Repair Activity and Therapeutic Methods Based Thereon THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2020-06-18 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-20200190034-A1 Inhibitors of Base Excision Repair Activity and Therapeutic Methods Based Thereon OGG1, UNG, MPG OGG1 1/4885TP53 206/4885RAB9A 2658/4885

“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.