SCHEMBL5124402

SCHEMBL5124402

Fc1ccc(CNc2nc(-c3ccno3)nc3sc(Cl)cc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
USP1 O94782 2/20 0.38
WDR48 Q8TAF3 2/20 0.38
POLB P06746 1/20 0.38
APP P05067 1/20 0.37
MAP2K4 P45985 1/20 0.37
PDE5A O76074 6/20 0.36
HRH4 Q9H3N8 1/20 0.36
USP10 Q14694 1/20 0.36
PIK3C3 Q8NEB9 1/20 0.36
USP13 Q92995 1/20 0.36
CHRM4 P08173 1/20 0.36
PTGS2 P35354 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 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
SCHEMBL5129162 0.91 PDE5A (0.43) MEN1KMT2ALMNAMAPTUSP1
SCHEMBL5129091 0.89 USP1 (0.44) USP1WDR48
SCHEMBL5128845 0.87 FLT3 (0.41) MEN1KMT2ALMNAMAPTUSP1
SCHEMBL5127701 0.86 PRKCI (0.47) MEN1KMT2ALMNAMAPTUSP1
SCHEMBL5130392 0.85 USP1 (0.43) MEN1KMT2ALMNAMAPTUSP1
SCHEMBL5115451 0.85 MEN1 (0.46) MEN1KMT2ALMNAMAPTAPP
SCHEMBL5130003 0.85 USP1 (0.47) MEN1KMT2ALMNAMAPTUSP1
SCHEMBL5123478 0.85 USP1 (0.41) MEN1KMT2ALMNAMAPTUSP1
SCHEMBL5121947 0.84 PDE5A (0.43) MEN1KMT2APDE5A
SCHEMBL5128125 0.83 HTT (0.39) MEN1KMT2ALMNAMAPTUSP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080045529-A1 Use Of Thienopyrimidines MERCK PATENT GMBH (DE) 2008-02-21 US disclosed
US-6432950-B1 ANTICANCER AGENTS; KILLING CANCER CELLS CELL PATHWAYS 2002-08-13 US disclosed
US-6133271-A Method for inhibiting neoplastic cells and related conditions by exposure thienopyrimidine derivatives CELL PATHWAYS, INC. (US) 2000-10-17 US disclosed
US-6110920-A TREATMENT OF CARDIOVASCULAR DISORDERS AND IMPOTENCY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-08-29 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-20080045529-A1 Use Of Thienopyrimidines TIE1, DPYD, TK2 MEN1 696/4885KMT2A 388/4885LMNA 3799/4885

“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.