SCHEMBL23117477

SCHEMBL23117477

Cc1cc(I)cc2c(Cl)cc(=O)[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.38
TP53 P04637 1/20 0.38
LMNA P02545 1/20 0.38
NQO2 P16083 6/20 0.37
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
CYP19A1 P11511 4/20 0.34
TNKS2 Q9H2K2 2/20 0.34

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
SCHEMBL20680392 0.79 MAPT (0.46) MAPTSMN1; SMN2TP53LMNANQO2
SCHEMBL9431360 0.74 KDM4E (0.61) MAPTLMNANQO2KDM4EALDH1A1
SCHEMBL23117491 0.71 CD38 (0.56) MAPT
SCHEMBL2906293 0.69 F2 (0.37) HSD17B10GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL20680204 0.68 AR (0.51) MAPTSMN1; SMN2TP53LMNAKDM4E
SCHEMBL9952985 0.67 CYP1A2 (0.43) CYP1A2
SCHEMBL12559632 0.67 MAPT (0.51) MAPTSMN1; SMN2TP53LMNANQO2
SCHEMBL13425992 0.66 ABCB1 (0.72) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL8258156 0.65 PARP4 (0.38) LMNAKDM4EALDH1A1GLAGAA
SCHEMBL29617331 0.64 MAPT (0.60) MAPTSMN1; SMN2TP53LMNANQO2

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-20210087290-A1 COMPOUNDS WHICH SPECIFICALLY BIND TO CD38 FOR USE IN THE TREATMENT OF NEURODEGENERATIVE AND INFLAMMATORY DISEASES ENCEFA (FR) 2021-03-25 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 (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-20210087290-A1 COMPOUNDS WHICH SPECIFICALLY BIND TO CD38 FOR USE IN THE TREATMENT OF NEURODEGENERATIVE AND INFLAMMATORY DISEASES CD38, TRPC1, TRPC4 MAPT 636/4885SMN1; SMN2 1111/4885TP53 1799/4885

“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.