SCHEMBL6449271

SCHEMBL6449271

O=C(Nc1ccc(-n2ccnc2)cc1)c1ccc(C(=O)Nc2nnc(-c3cc(Cl)cc(Cl)c3O)s2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
ADH5 P11766 2/20 0.43
ROCK1 Q13464 1/20 0.43
KMT2A Q03164 3/20 0.42
F10 P00742 1/20 0.42
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 1/20 0.40
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA2B P29275 1/20 0.40
ADORA1 P30542 1/20 0.40
HTT P42858 1/20 0.39
BLM P54132 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39

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
SCHEMBL6325903 0.90 BLM (0.49) LMNAKMT2ACYP3A4CYP2D6PSEN1
SCHEMBL6326664 0.89 BLM (0.46) LMNAADH5KMT2ACYP3A4CYP2D6
SCHEMBL6449334 0.86 SERPINE1 (0.47) LMNAKMT2AALDH1A1MAPTMEN1
SCHEMBL6447047 0.86 KDM4E (0.41) LMNAKMT2AF10HTTBLM
SCHEMBL6448563 0.85 F10 (0.42) LMNAKMT2AF10CYP3A4ALDH1A1
SCHEMBL6447202 0.85 KMT2A (0.46) KMT2AHTTBLMMAPTMEN1
SCHEMBL6444272 0.84 RXFP1 (0.48) LMNAROCK1KMT2ABLMALDH1A1
SCHEMBL6445978 0.84 SNCA (0.47) LMNAKMT2AHTTALDH1A1MEN1
SCHEMBL6447053 0.83 CSNK2A2 (0.49) KMT2AALDH1A1MAPTMEN1KDM4E
SCHEMBL6445760 0.83 CSNK2A2 (0.52) KMT2AALDH1A1MAPTMEN1KDM4E

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-20050143384-A1 Amide thiadiazole inhibitors of plasminogen activator inhibitor-1 BRISTOL-MYERS SQUIBB COMPANY 2005-06-30 US claimed
US-20050143384-A1 Amide thiadiazole inhibitors of plasminogen activator inhibitor-1 BRISTOL-MYERS SQUIBB COMPANY 2005-06-30 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-20050143384-A1 Amide thiadiazole inhibitors of plasminogen activator inhibitor-1 SERPINE1, SERPINC1, SERPINB1 LMNA 1668/4885ADH5 343/4885ROCK1 885/4885

“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.