SCHEMBL3477836

SCHEMBL3477836

CC(C)(C)C1CN(c2cc(-c3cc(Cl)ccc3O)ccn2)CCN1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 3/20 0.45
SHMT1 P34896 1/20 0.37
SHMT2 P34897 1/20 0.37
ESD P10768 1/20 0.37
GRM1 Q13255 1/20 0.37
MGLL Q99685 1/20 0.36
ANO1 Q5XXA6 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GRM5 P41594 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
MEN1 O00255 1/20 0.34
IDE P14735 1/20 0.34
KMT2A Q03164 1/20 0.34
PROKR1 Q8TCW9 1/20 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
SCHEMBL3477785 0.82 SLC6A7 (0.49) SLC6A7MEN1IDEKMT2A
SCHEMBL322939 0.81 MGLL (0.48) MGLLHSD17B10GRM5KDM4EALDH1A1
SCHEMBL1094651 0.75 SMARCA2 (0.46) MGLLANO1KDM4EALDH1A1CYP1A2
SCHEMBL5527891 0.72 SLC6A7 (0.41) SLC6A7GRM1
SCHEMBL26096238 0.71 GRM1 (0.38) SLC6A7GRM1CHRM2CHRM1CHRM3
SCHEMBL22638185 0.70 ME2 (0.51) SLC6A7GRM1CYP2C9KMT2A
SCHEMBL21981500 0.70 PANK3 (0.41) SLC6A7GRM1CHRM2CHRM1
SCHEMBL4690127 0.69 CNR1 (0.52) SLC6A7
SCHEMBL28554484 0.69 SLC6A7 (0.41) SLC6A7GRM1
SCHEMBL3106388 0.68 PTGES (0.51)

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-20100197655-A1 SULFONAMIDE DERIVATIVES Pfizer Limited Icagen, Inc. 2010-08-05 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-20100197655-A1 SULFONAMIDE DERIVATIVES SULT2A1, SULT1A1, TPST2 SLC6A7 762/4885SHMT1 2055/4885SHMT2 1540/4885

“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.