SCHEMBL6325574

SCHEMBL6325574

Cc1ccc(-c2noc(CCC(=O)NCCCNc3n[nH]c(=O)c4ccccc34)n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
MAPT P10636 3/20 0.56
LMNA P02545 6/20 0.54
HTT P42858 3/20 0.54
USP2 O75604 3/20 0.54
MAPK1 P28482 2/20 0.54
HPGD P15428 4/20 0.53
ALDH1A1 P00352 3/20 0.53
ALOX15 P16050 1/20 0.53
TP53 P04637 1/20 0.51
GAA P10253 2/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL6327228 0.98 TSHR (0.58) TSHRSMN1; SMN2MAPTLMNAHTT
SCHEMBL6328500 0.96 GAA (0.54) TSHRSMN1; SMN2MAPTLMNAHTT
SCHEMBL6326417 0.95 TSHR (0.60) TSHRSMN1; SMN2MAPTLMNAHTT
SCHEMBL6332642 0.94 GAA (0.54) TSHRSMN1; SMN2MAPTLMNAHTT
SCHEMBL6327904 0.93 HPGD (0.59) TSHRSMN1; SMN2MAPTLMNAHTT
SCHEMBL6328284 0.92 HPGD (0.52) TSHRSMN1; SMN2MAPTLMNAHTT
SCHEMBL6323594 0.92 TSHR (0.51) TSHRSMN1; SMN2LMNAHTTUSP2
SCHEMBL6326111 0.92 TSHR (0.51) TSHRSMN1; SMN2MAPTLMNAHTT
SCHEMBL5072002 0.92 HPGD (0.51) TSHRSMN1; SMN2MAPTLMNAHTT
SCHEMBL6325121 0.92 GAA (0.54) TSHRSMN1; SMN2MAPTLMNAHTT

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-6924284-B2 PARP inhibitors ICOS CORPORATION (US) 2005-08-02 US disclosed
US-20040087588-A1 Parp inhibitors ICOS CORPORATION 2004-05-06 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-20040087588-A1 Parp inhibitors PARP1, PARP2, PARP11 TSHR 4656/4885SMN1; SMN2 3494/4885MAPT 729/4885

“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.