SCHEMBL6416255

SCHEMBL6416255

Cc1cc(C(=O)N2CCN(c3ccccc3)CC2)n(-c2ccccc2)n1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.65
LMNA P02545 4/20 0.59
ALDH1A1 P00352 3/20 0.54
KMT2A Q03164 4/20 0.54
USP2 O75604 3/20 0.54
MEN1 O00255 3/20 0.54
MAPT P10636 5/20 0.54
MAPK1 P28482 3/20 0.54
MGLL Q99685 1/20 0.52
HTT P42858 1/20 0.51
RAB9A P51151 1/20 0.51

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
SCHEMBL6415472 0.95 TSHR (0.60) TSHRLMNAALDH1A1KMT2AUSP2
SCHEMBL6262017 0.92 TSHR (0.60) TSHRLMNAALDH1A1KMT2AUSP2
SCHEMBL6415123 0.92 TSHR (0.57) TSHRLMNAALDH1A1KMT2AUSP2
SCHEMBL6262844 0.91 TSHR (0.59) TSHRLMNAALDH1A1KMT2AUSP2
SCHEMBL6415443 0.91 TSHR (0.59) TSHRLMNAALDH1A1KMT2AUSP2
SCHEMBL6416330 0.91 MAPT (0.63) TSHRLMNAALDH1A1KMT2AUSP2
SCHEMBL6262956 0.90 TSHR (0.58) TSHRLMNAALDH1A1KMT2AUSP2
SCHEMBL6263812 0.90 TSHR (0.58) TSHRLMNAALDH1A1KMT2AUSP2
SCHEMBL6261742 0.90 TSHR (0.58) TSHRLMNAALDH1A1KMT2AUSP2
SCHEMBL29495713 0.90 LMNA (0.65) TSHRLMNAALDH1A1KMT2AMEN1

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-20050130989-A1 N-arylheteroaromatic products compositions containing them and use thereof AVENTIS PHARMA S. A. (FR) 2005-06-16 US claimed

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-20050130989-A1 N-arylheteroaromatic products compositions containing them and use thereof AHR, NQO1, ARNT TSHR 4236/4885LMNA 2233/4885ALDH1A1 360/4885

“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.