SCHEMBL24413993

SCHEMBL24413993

COC(=O)c1cc(N)c(I)cc1C(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 3/20 0.58
NQO2 P16083 1/20 0.54
KDM4E B2RXH2 7/20 0.52
ALDH1A1 P00352 5/20 0.50
GAA P10253 5/20 0.50
HSD17B10 Q99714 3/20 0.50
MAPT P10636 2/20 0.50
HPGD P15428 2/20 0.50
GLA P06280 2/20 0.50
CASP1 P29466 1/20 0.50
CASP7 P55210 1/20 0.50
ATM Q13315 1/20 0.50
ABL1 P00519 1/20 0.49
TSHR P16473 2/20 0.47
ALOX15 P16050 1/20 0.47
POLB P06746 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL3974563 0.87 GAA (0.54) CFTRNQO2KDM4EALDH1A1GAA
SCHEMBL2690892 0.87 KDM4E (0.50) CFTRNQO2KDM4EALDH1A1GAA
SCHEMBL29790105 0.87 KDM4E (0.50) CFTRNQO2KDM4EALDH1A1GAA
SCHEMBL3970865 0.87 CFTR (0.54) CFTRNQO2KDM4EALDH1A1GAA
SCHEMBL28922445 0.86 CFTR (0.66) CFTRNQO2KDM4EALDH1A1GAA
SCHEMBL21929291 0.85 CFTR (0.56) CFTRNQO2KDM4EALDH1A1GAA
SCHEMBL31515143 0.85 GAA (0.53) CFTRNQO2KDM4EALDH1A1GAA
SCHEMBL23536211 0.85 NQO2 (0.49) CFTRNQO2KDM4EALDH1A1GAA
SCHEMBL23874532 0.85 GAA (0.61) CFTRNQO2KDM4EALDH1A1GAA
SCHEMBL2596444 0.85 GAA (0.66) CFTRNQO2KDM4EALDH1A1GAA

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-20220143183-A1 PHOTOSWITCHABLE PROTACS AND SYNTHESIS AND USES THEREOF NEW YORK UNIVERSITY 2022-05-12 US disclosed
US-20220143183-A1 PHOTOSWITCHABLE PROTACS AND SYNTHESIS AND USES THEREOF NEW YORK UNIVERSITY 2022-05-12 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-20220143183-A1 PHOTOSWITCHABLE PROTACS AND SYNTHESIS AND USES THEREOF MDM2, UBE3C, CUL1 CFTR 4655/4885NQO2 3721/4885KDM4E 1635/4885

“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.