SCHEMBL22928039

SCHEMBL22928039

CC(C)(C)c1cccc(NS(=O)(=O)c2ccno2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPK1 P28482 1/20 0.47
CYP2C19 P33261 1/20 0.47
BRS3 P32247 1/20 0.45
KMT2A Q03164 1/20 0.45
CDK1 P06493 2/20 0.45
CCNB1 P14635 2/20 0.45
CCNA2 P20248 2/20 0.45
CDK2 P24941 2/20 0.45
CDK7 P50613 2/20 0.45
CCNH P51946 2/20 0.45
CCNA1 P78396 2/20 0.45
FFAR1 O14842 1/20 0.45
FFAR4 Q5NUL3 1/20 0.45
UQCRB P14927 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CCND1 P24385 1/20 0.44

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
SCHEMBL22619085 0.82 KMT2A (0.52) MAPTCYP3A4MAPK1CYP2C19KMT2A
SCHEMBL22928038 0.78 CCR2 (0.47) MAPTCYP1A2CYP3A4MAPK1CYP2C19
SCHEMBL22928030 0.77 BRS3 (0.44) MAPTCYP1A2CYP3A4MAPK1CYP2C19
SCHEMBL22928040 0.76 UQCRB (0.51) MAPTCYP1A2CYP3A4MAPK1CYP2C19
SCHEMBL22928037 0.75 UQCRB (0.44) MAPTCYP1A2CYP3A4MAPK1CYP2C19
SCHEMBL22928032 0.75 UQCRB (0.44) MAPTCYP1A2CYP3A4MAPK1CYP2C19
SCHEMBL7758975 0.74 SLC40A1 (0.47) MAPTCYP1A2CYP3A4MAPK1CYP2C19
SCHEMBL678551 0.74 CA1 (0.65) KMT2ACDK1CCNB1CCNA2CDK2
SCHEMBL22928010 0.73 UQCRB (0.45) MAPTCYP1A2CYP3A4MAPK1CYP2C19
SCHEMBL22928036 0.73 UQCRB (0.45) MAPTCYP1A2CYP3A4MAPK1CYP2C19

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-20210024498-A1 TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF MEDICONNS SHANGHAI BIOPHARMACEUTICAL CO LTD (CN) 2021-01-28 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-20210024498-A1 TETRAHYDROPYRROLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF PRLHR, DRD2, AVPR2 MAPT 1968/4885CYP1A2 1137/4885CYP3A4 542/4885

“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.