SCHEMBL24045320

SCHEMBL24045320

Cc1ccc(NCCSc2nccn2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 3/20 0.47
TP53 P04637 1/20 0.47
THRB P10828 1/20 0.47
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL24045260 0.78 MAPT (0.75) POLBMAPTLMNATP53THRB
SCHEMBL24045322 0.78 MAPT (0.75) POLBMAPTLMNATP53THRB
SCHEMBL10400360 0.75 SMN1; SMN2 (0.52) POLBMAPTLMNATP53THRB
Hydrochloric Acid SCHEMBL11377342 0.72 POLB (0.54) POLBTP53THRBALDH1A1SMN1; SMN2
SCHEMBL24045352 0.71 MAPT (0.83) POLBMAPTLMNATP53THRB
SCHEMBL11526668 0.69 MAPT (0.77) MAPTLMNATP53ALDH1A1MEN1
SCHEMBL24943943 0.69 L3MBTL1 (0.61) POLBLMNATP53THRBALDH1A1
SCHEMBL26687689 0.68 MAPT (0.83) POLBMAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL24045327 0.68 MAPT (0.79) POLBMAPTTP53ALDH1A1SMN1; SMN2
SCHEMBL27729355 0.68 MAPKAPK2 (0.55)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11591304-B2 SLC26A3 inhibitors and use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-02-28 US disclosed
US-20210363123-A1 SLC26A3 INHIBITORS AND USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-11-25 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 (2 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-20210363123-A1 SLC26A3 INHIBITORS AND USE THEREOF SLC26A3, SLC10A2, SLC10A6 POLB 2167/4885MAPT 3087/4885LMNA 4229/4885
US-11591304-B2 SLC26A3 inhibitors and use thereof SLC26A3, SLC10A2, SLC10A6 POLB 2167/4885MAPT 3087/4885LMNA 4229/4885

“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.