SCHEMBL19987769

SCHEMBL19987769

CCc1cc(OS(=O)(=O)CC)no1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
THRB P10828 1/20 0.35
CA2 P00918 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TP53 P04637 1/20 0.34
ALPL P05186 2/20 0.33
ALPI P09923 2/20 0.33
MMP2 P08253 1/20 0.33
MMP7 P09237 1/20 0.33
MMP9 P14780 1/20 0.33
MMP14 P50281 1/20 0.33
CA12 O43570 1/20 0.31
MAPT P10636 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL28203217 0.86 ALDH1A1 (0.35) ALDH1A1THRBSMN1; SMN2TP53
SCHEMBL11362944 0.82 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL11367979 0.81 ALDH1A1 (0.39) ALDH1A1CA2SMN1; SMN2ALPLALPI
SCHEMBL14367311 0.79 NPC1 (0.41) ALDH1A1SMN1; SMN2TP53MAPTNPC1
SCHEMBL28536125 0.77 SMN1; SMN2 (0.36) ALDH1A1THRBSMN1; SMN2TP53MAPT
SCHEMBL10283737 0.75
SCHEMBL10157734 0.73
SCHEMBL16571266 0.71 ALDH1A1 (0.48) ALDH1A1THRBSMN1; SMN2TP53MAPT
SCHEMBL14228524 0.69 SMPD1 (0.47) ALDH1A1
SCHEMBL19987770 0.69 TP53 (0.33) ALDH1A1THRBSMN1; SMN2TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10278973-B2 Hydroxyl purine compounds and use thereof Guangdong Raynovent Biotech Co., Ltd. (CN) 2019-05-07 US disclosed
US-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF Guangdong Raynovent Biotech Co., Ltd. (CN) 2018-05-24 US disclosed
EP-3299371-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-03-28 EP 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-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF PNP, PDE7A, PDE2A ALDH1A1 379/4885THRB 1588/4885CA2 1772/4885
US-10278973-B2 Hydroxyl purine compounds and use thereof PNP, PDE7A, PDE2A ALDH1A1 379/4885THRB 1588/4885CA2 1772/4885

“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.