SCHEMBL3857256

SCHEMBL3857256

Brc1ccc2c(c1)c1c(n2Cc2ccccc2)CCCC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.65
CA2 P00918 3/20 0.65
HTR6 P50406 3/20 0.58
FABP4 P15090 3/20 0.57
HDAC1 Q13547 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
HDAC10 Q969S8 1/20 0.53
PTGS1 P23219 1/20 0.52
PTGS2 P35354 1/20 0.52
SLC2A1 P11166 1/20 0.51
HTR1A P08908 1/20 0.51
HTR2A P28223 1/20 0.51
HTR7 P34969 1/20 0.51
LMNA P02545 2/20 0.50
HTT P42858 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
RECQL P46063 1/20 0.50
FABP3 P05413 1/20 0.50
TSHR P16473 1/20 0.49

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
SCHEMBL13478784 0.86 FABP3 (0.55) CA1CA2HTR6FABP4HDAC1
SCHEMBL7464584 0.85 CA1 (0.67) CA1CA2HTR6FABP4HDAC1
SCHEMBL6045346 0.83 CA1 (0.94) CA1CA2HTR6FABP4HDAC1
SCHEMBL4727325 0.80 MAPT (0.59) CA1CA2HTR6HDAC1HDAC6
SCHEMBL3853296 0.80 CA1 (0.59) CA1CA2HTR6FABP4HDAC1
SCHEMBL2244878 0.79 CYP19A1 (0.60) CA2HDAC1HDAC6LMNASMN1; SMN2
SCHEMBL31222301 0.79 CYP19A1 (0.60) CA2HDAC1HDAC6LMNASMN1; SMN2
SCHEMBL4193417 0.78 SCARB1 (0.46) CA1CA2HTR6HDAC1HDAC6
SCHEMBL3859121 0.77 HTR6 (0.67) CA1CA2HTR6FABP4PTGS1
Hydrochloric Acid SCHEMBL15267097 0.77 HTR6 (0.58) HTR6HTR1AHTR2AHTR7LMNA

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-7582773-B2 Substituted phenyl indoles WYETH (US) 2009-09-01 US disclosed
US-20050070592-A1 Substituted phenyl indoles WYETH (US) 2005-03-31 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-20050070592-A1 Substituted phenyl indoles TPH2, IDO2, AANAT CA1 2159/4885CA2 2739/4885HTR6 18/4885

“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.