SCHEMBL25812882

SCHEMBL25812882

CC1=C(C)C(S(=O)(=O)c2ccccc2)c2ccc(C)cc21

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.39
KAT6A Q92794 1/20 0.37
MMP2 P08253 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
ALDH1A1 P00352 4/20 0.35
METAP2 P50579 1/20 0.35
HSD11B1 P28845 1/20 0.35
KMT2A Q03164 2/20 0.34
FFAR4 Q5NUL3 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
AKR1C3 P42330 1/20 0.33
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL25812739 0.85 NAT1 (0.38) ALDH1A1KMT2ACA1CA2CA9
SCHEMBL25811432 0.84 HTR6 (0.36) KAT6AALDH1A1CA1CA2CA9
SCHEMBL25811437 0.83 NAT1 (0.35) MAOAMAOBALDH1A1KMT2ACA1
SCHEMBL16383945 0.82 ELANE (0.42) ELANEKAT6AMMP2MAOAMAOB
SCHEMBL25811421 0.81 PTGS2 (0.46) MMP2KMT2ACA1CA2CA9
SCHEMBL10147702 0.72 KAT6A (0.38) ELANEKAT6AMMP2ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL27515760 0.63 MAOA (0.36) ELANEMAOAMAOB
SCHEMBL3884518 0.62 HTR6 (0.61) KAT6AMMP2ALDH1A1KMT2ALMNA
SCHEMBL777972 0.61 KAT6A (0.57) KAT6AALDH1A1KMT2ACA1CA2
SCHEMBL19538864 0.61 GAA (0.36) MMP2ALDH1A1FFAR4CA1CA2

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-20230218573-A1 INDOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES GALYAN BIO INC (US) 2023-07-13 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-20230218573-A1 INDOLE COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES HTT, HYPK, PARK7 ELANE 4196/4885KAT6A 452/4885MMP2 4186/4885

“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.