SCHEMBL7236333

SCHEMBL7236333

O=C(Nc1ccc2c(c1)N(Cc1c[nH]cn1)CC(Cc1ccccc1)NS2)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.38
TP53 P04637 2/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
ACHE P22303 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GFER P55789 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ACKR3 P25106 2/20 0.35
PPARA Q07869 3/20 0.34
LMNA P02545 1/20 0.34
PPARG P37231 1/20 0.34
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
HTR2A P28223 1/20 0.33

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
SCHEMBL7245829 0.87 ACKR3 (0.38) KDM4EACKR3FNTAFNTB
SCHEMBL6634720 0.72 FNTA (0.40) KDM4EACKR3FNTAFNTB
SCHEMBL3500565 0.68 FNTA (0.33) FNTAFNTB
SCHEMBL7245699 0.67 KDM4E (0.40) KDM4EACKR3FNTAFNTBDRD3
SCHEMBL12405631 0.66 MAPT (0.53) MAPTTP53KDM4EGFERTDP1
SCHEMBL3499254 0.65 FNTA (0.43) MAPTKDM4EACKR3LMNAFNTA
SCHEMBL12404770 0.65 MAPT (0.46) MAPTTP53KDM4EGFERTDP1
SCHEMBL3501412 0.65 FNTA (0.74) LMNAFNTAFNTB
SCHEMBL12360033 0.65 EPHX2 (0.45) MAPTLMNA
SCHEMBL12359901 0.65 TSHR (0.44) MAPTTP53LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6624157-B2 Antitumor agents BRISTOL-MYERS SQUIBB COMPANY 2003-09-23 US claimed
US-20010039273-A1 Thiadioxobenzodiazepine inhibitors of farnesyl protein transferase DING CHARLES Z (US) 2001-11-08 US claimed
EP-0918771-A4 THIADIOXOBENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL MYERS SQUIBB CO (US) 2001-02-07 EP claimed
EP-0918771-A1 THIADIOXOBENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-06-02 EP claimed
WO-1998002436-A1 THIADIOXOBENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1998-01-22 WO claimed
US-6624157-B2 Antitumor agents BRISTOL-MYERS SQUIBB COMPANY 2003-09-23 US disclosed
US-20010039273-A1 Thiadioxobenzodiazepine inhibitors of farnesyl protein transferase DING CHARLES Z (US) 2001-11-08 US disclosed
EP-0918771-A4 THIADIOXOBENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL MYERS SQUIBB CO (US) 2001-02-07 EP disclosed
EP-0918771-A1 THIADIOXOBENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-06-02 EP disclosed
WO-1998002436-A1 THIADIOXOBENZODIAZEPINE INHIBITORS OF FARNESYL PROTEIN TRANSFERASE BRISTOL-MYERS SQUIBB COMPANY (US) 1998-01-22 WO 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-20010039273-A1 Thiadioxobenzodiazepine inhibitors of farnesyl protein transferase CBR1, CBR3, FNTB MAPT 4563/4885TP53 1154/4885ITGB3 3016/4885

“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.