SCHEMBL4324286

SCHEMBL4324286

CCCC[C@H](NC(=O)OCc1ccccc1)c1nc(-c2ccccc2)c[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.51
CTSS P25774 2/20 0.51
HDAC1 Q13547 7/20 0.50
HDAC6 Q9UBN7 7/20 0.50
HDAC3 O15379 6/20 0.50
HDAC4 P56524 6/20 0.50
HDAC7 Q8WUI4 6/20 0.50
HDAC2 Q92769 6/20 0.50
HDAC10 Q969S8 6/20 0.50
HDAC11 Q96DB2 6/20 0.50
HDAC8 Q9BY41 6/20 0.50
HDAC9 Q9UKV0 6/20 0.50
HDAC5 Q9UQL6 6/20 0.50
CTSK P43235 3/20 0.44
CTSB P07858 1/20 0.44
SSTR1 P30872 1/20 0.44
TACR1 P25103 1/20 0.44
SIRT2 Q8IXJ6 4/20 0.43
SIRT1 Q96EB6 3/20 0.43
MME P08473 1/20 0.43

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
SCHEMBL4324281 1.00 CTSL (0.51) CTSLCTSSHDAC1HDAC6HDAC3
SCHEMBL2787667 0.87 CTSL (0.44) CTSLCTSSHDAC1HDAC6HDAC3
SCHEMBL2787669 0.87 CTSL (0.44) CTSLCTSSHDAC1HDAC6HDAC3
SCHEMBL2343173 0.85 TACR3 (0.47) MME
SCHEMBL2343176 0.85 TACR3 (0.47) MME
SCHEMBL1928257 0.83 CTSK (0.47) CTSSCTSK
SCHEMBL1928254 0.83 CTSK (0.47) CTSSCTSK
SCHEMBL12971777 0.83 ATM (0.55) CTSLCTSSCTSKCTSBSSTR1
SCHEMBL1927634 0.83 TACR3 (0.46) HDAC1HDAC3HDAC2HDAC8MME
SCHEMBL1505365 0.83 ATM (0.55) CTSLCTSSCTSKCTSBSSTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7553975-B2 Farnesyl transferase inhibitors IPSEN PHARMA S.A.S. (FR) 2009-06-30 US disclosed
US-7323484-B2 Farnesyl transferase inhibitors SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES, S.A.S. (FR) 2008-01-29 US disclosed
US-20060252760-A1 Farnesyl transferase inhibitors IPSEN PHARMA S.A.S. (FR) 2006-11-09 US disclosed
US-20060079530-A1 Farnesyl transferase inhibitors IPSEN PHARMA S.A.S. (FR) 2006-04-13 US disclosed
US-7022704-B2 5,6,7, 8-tetrahydro-imidazo-(1,2a)-pyrazine derivative; useful for treating restenosis and tumor SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES, S.A.S. (FR) 2006-04-04 US disclosed
EP-0904274-B1 FARNESYL TRANSFERASE INHIBITORS CONSEILS DE RECH SET D APPLIC (FR) 2005-05-25 EP disclosed
US-6673927-B2 FOR THERAPY OF TUMOR OR RESTENOSIS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES, S.A.S. (FR) 2004-01-06 US disclosed
US-20030119864-A1 Farnesyl transferase inhibitors BIOMEASURE INCORPORATED, A MASSACHUSETTS CORPORATION 2003-06-26 US disclosed
US-20020013319-A1 FARNESYL TRANSFERASE INHIBITORS IPSEN PHARMA S.A.S. (FR) 2002-01-31 US disclosed
EP-0904274-A4 FARNESYL TRANSFERASE INHIBITORS BIOMEASURE INC (US) 1999-12-29 EP disclosed
EP-0904274-A1 FARNESYL TRANSFERASE INHIBITORS Biomeasure Incorporated (US) 1999-03-31 EP disclosed
WO-1997030053-A1 FARNESYL TRANSFERASE INHIBITORS BIOMEASURE INCORPORATED (US) 1997-08-21 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-20060079530-A1 Farnesyl transferase inhibitors FNTB, FNTA, LCAT CTSL 2244/4885CTSS 2218/4885HDAC1 1907/4885
US-20060252760-A1 Farnesyl transferase inhibitors FNTB, FNTA, LCAT CTSL 2244/4885CTSS 2218/4885HDAC1 1907/4885
US-20030119864-A1 Farnesyl transferase inhibitors FNTB, FNTA, LCAT CTSL 2244/4885CTSS 2218/4885HDAC1 1907/4885
US-20020013319-A1 FARNESYL TRANSFERASE INHIBITORS FNTB, FNTA, LCAT CTSL 2244/4885CTSS 2218/4885HDAC1 1907/4885

“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.