SCHEMBL6417191

SCHEMBL6417191

Cc1nc(C=O)cn1Cc1ccc(C#N)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 14/20 0.38
CACNA1G O43497 1/20 0.38
CACNA1I Q9P0X4 1/20 0.38
PDE2A O00408 1/20 0.38
SOS1 Q07889 1/20 0.38
P2RX7 Q99572 2/20 0.37
TRPV4 Q9HBA0 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36

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
SCHEMBL2359169 0.75 MAPT (0.46) CACNA1HCACNA1GCACNA1ISOS1CYP11B1
SCHEMBL6410513 0.74 CACNA1H (0.39) CACNA1HCACNA1GCACNA1IPDE2ACYP11B1
SCHEMBL7966541 0.74 LMNA (0.48) CACNA1HCACNA1GCACNA1IPDE2ATRPV4
SCHEMBL6409767 0.73 CYP11B1 (0.64) CACNA1HCACNA1GCACNA1ITRPV4CYP11B1
SCHEMBL32683820 0.71 FGFR1 (0.43) CACNA1HCACNA1GCACNA1IPDE2ATRPV4
SCHEMBL31674269 0.71 APP (0.46) CACNA1HCACNA1GCACNA1ITRPV4
SCHEMBL32684047 0.70 PDE2A (0.39) CACNA1HCACNA1GCACNA1IPDE2AP2RX7
SCHEMBL2724753 0.68 TRPV4 (0.53) TRPV4CYP11B1CYP11B2
SCHEMBL7713277 0.68 CYP11B1 (0.46) CYP11B1CYP11B2
SCHEMBL6417203 0.67 DAO (0.40) CACNA1HCACNA1GCACNA1ITRPV4CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1090012-A4 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO INC (US) 2005-04-06 EP disclosed
US-6562823-B1 Inhibition of farnesyl-protein transferase has been shown to block the growth of Ras-transformed cells in soft agar MERCK & CO., INC. 2003-05-13 US disclosed
US-20020193283-A1 Inhibitors of prenyl-protein transferase DINSMORE CHRISTOPHER J (US) 2002-12-19 US disclosed
US-20020052363-A1 Inhibitors of prenyl-protein transferase DINSMORE CHRISTOPHER J (US) 2002-05-02 US disclosed
US-20020052380-A1 Inhibitors of prenyl-protein transferase DINSMORE CHRISTOPHER J (US) 2002-05-02 US disclosed
US-20020010184-A1 Inhibitors of prenyl-protein transferase DINSMORE CHRISTOPHER J (US) 2002-01-24 US disclosed
WO-2001060368-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-08-23 WO disclosed
WO-2001060458-A2 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-08-23 WO disclosed
WO-2001060369-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-08-23 WO disclosed
WO-2001060815-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-08-23 WO disclosed
EP-1090012-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2001-04-11 EP disclosed
WO-2000016778-A1 A METHOD OF TREATING CANCER MERCK & CO., INC. (US) 2000-03-30 WO disclosed
WO-2000001702-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2000-01-13 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 (4 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-20020010184-A1 Inhibitors of prenyl-protein transferase FNTA, FNTB, ZMPSTE24 CACNA1H 4079/4885CACNA1G 4261/4885CACNA1I 3518/4885
US-20020193283-A1 Inhibitors of prenyl-protein transferase FNTA, FNTB, PTAR1 CACNA1H 4625/4885CACNA1G 4514/4885CACNA1I 4110/4885
US-20020052363-A1 Inhibitors of prenyl-protein transferase FNTA, FNTB, PTAR1 CACNA1H 4625/4885CACNA1G 4514/4885CACNA1I 4110/4885
US-20020052380-A1 Inhibitors of prenyl-protein transferase FNTA, FNTB, GGPS1 CACNA1H 4564/4885CACNA1G 4483/4885CACNA1I 4045/4885

“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.