SCHEMBL3138986

SCHEMBL3138986

CC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
HSD17B10 Q99714 2/20 0.55
CYP2C19 P33261 1/20 0.55
FKBP1A P62942 4/20 0.51
ACE P12821 6/20 0.47
REN P00797 3/20 0.47
KDM4E B2RXH2 1/20 0.47
F2 P00734 1/20 0.47
LTA4H P09960 1/20 0.47
MAPT P10636 1/20 0.47
PEPD P12955 1/20 0.47
ALOX15 P16050 1/20 0.47
PTGS1 P23219 1/20 0.47
HTR2A P28223 1/20 0.47
PTGS2 P35354 1/20 0.47
HRH1 P35367 1/20 0.47
THPO P40225 1/20 0.47
PMP22 Q01453 1/20 0.47
ACE2 Q9BYF1 1/20 0.47
RAB9A P51151 1/20 0.46

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
SCHEMBL5966188 1.00 LMNA (0.55) LMNAHSD17B10CYP2C19FKBP1AACE
SCHEMBL5966112 0.95 FKBP1A (0.57) LMNAHSD17B10CYP2C19FKBP1A
SCHEMBL5966063 0.95 FKBP1A (0.57) LMNAHSD17B10CYP2C19FKBP1A
SCHEMBL5966065 0.95 FKBP1A (0.57) LMNAHSD17B10CYP2C19FKBP1A
SCHEMBL27714243 0.93 FKBP1A (0.58) LMNAHSD17B10CYP2C19FKBP1A
SCHEMBL7255035 0.89 FKBP1A (0.43) LMNAHSD17B10CYP2C19FKBP1AACE
SCHEMBL3330557 0.83 LMNA (0.57) LMNAHSD17B10CYP2C19FKBP1AACE
Gpi-1485 SCHEMBL3568704 0.83 FKBP1A (0.66) LMNAHSD17B10CYP2C19FKBP1A
Gpi-1485 SCHEMBL2006950 0.83 FKBP1A (0.66) LMNAHSD17B10CYP2C19FKBP1A
SCHEMBL2636385 0.81 LMNA (0.68) LMNAHSD17B10CYP2C19ACEREN

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 74 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7282510-B2 Small molecule inhibitors of rotamase enzyme activity GLIAMED, INC. (US) 2007-10-16 US claimed
EP-1227859-B1 NEUROPHILIN LIGANDS FOR TREATING OCULAR CONDITIONS ALCON INC (CH) 2006-08-09 EP claimed
US-20050272780-A1 Small molecule inhibitors of rotamase enzyme activity GUILFORD NIL HOLDINGS, INC. 2005-12-08 US claimed
US-6943187-B2 Pyrrolidine derivative hair growth compositions and uses GPI NIL HOLDINGS, INC. (US) 2005-09-13 US claimed
US-20040186098-A1 Method for preventing and treating hearing loss using sensorineurotrophic compounds AMGEN INC. 2004-09-23 US claimed
EP-1404325-A2 METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY GUILFORD PHARMACEUTICALS INC. (US) 2004-04-07 EP claimed
US-20040049046-A1 Small molecule inhibitors of rotamase enzyme activity GPI NIL HOLDINGS, INC. (US) 2004-03-11 US claimed
US-20030203890-A1 Method for treating nerve injury caused as a result of surgery NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2003-10-30 US claimed
US-20020198250-A1 Pyrrolidine derivative hair growth compositions and uses GLIAMED, INC. 2002-12-26 US claimed
WO-2002096420-A2 METHOD FOR TREATING NERVE INJURY CAUSED BY SURGERY GUILFORD PHARMACEUTICALS INC. (US) 2002-12-05 WO claimed
US-6218423-B1 ADMINISTERING PYRROLIDINE DERIVATIVE FOR THERAPY OF NERVE-RELATED VISION DISORDER, IMPROVING VISION, TREATING MEMORY IMPAIRMENT, OR ENHANCING MEMORY PERFORMANCE IN ANIMAL GPI NIL HOLDINGS, INC. 2001-04-17 US claimed
US-6177455-B1 ADMINISTERING A NITROGEN-CONTAINING HETEROCYCLIC COMPOUND GPI NIL HOLDINGS, INC. 2001-01-23 US claimed
EP-0769006-B1 SMALL MOLECULE INHIBITORS OF ROTAMASE ENZYME ACTIVITY GUILFORD PHARM INC (US) 2000-11-08 EP claimed
EP-0992492-A1 Small molecule inhibitors of rotamase enzyme activity GUILFORD PHARMACEUTICALS INC. (US) 2000-04-12 EP claimed
US-5945441-A ADMINISTERING TO PROMOTE HAIR GERMINATION GPI NIL HOLDINGS, INC. (US) 1999-08-31 US claimed
US-5859031-A Small molecule inhibitors of rotamase enzyme activity GPI NIL HOLDINGS, INC. (US) 1999-01-12 US claimed
EP-0769006-A4 GUILFORD PHARM INC (US) 1997-05-28 EP claimed
EP-0769006-A1 SMALL MOLECULE INHIBITORS OF ROTAMASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1997-04-23 EP claimed
WO-1996040633-A9 SMALL MOLECULE INHIBITORS OF ROTAMASE ENZYME ACTIVITY 1997-02-27 WO claimed
WO-1996040633-A1 SMALL MOLECULE INHIBITORS OF ROTAMASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1996-12-19 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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-20040186098-A1 Method for preventing and treating hearing loss using sensorineurotrophic compounds GAP43, CHAT, MYOC LMNA 956/4885HSD17B10 1997/4885CYP2C19 4807/4885
US-20030203890-A1 Method for treating nerve injury caused as a result of surgery NGF, BDNF, GAP43 LMNA 1638/4885HSD17B10 951/4885CYP2C19 3931/4885
US-20040049046-A1 Small molecule inhibitors of rotamase enzyme activity FKBP8, FKBP14, PREP LMNA 4805/4885HSD17B10 2163/4885CYP2C19 3078/4885
US-20050272780-A1 Small molecule inhibitors of rotamase enzyme activity FKBP8, FKBP1A, PREP LMNA 4762/4885HSD17B10 1755/4885CYP2C19 2787/4885
US-20020198250-A1 Pyrrolidine derivative hair growth compositions and uses MKI67, PLOD2, HDGF LMNA 4536/4885HSD17B10 574/4885CYP2C19 1291/4885

“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.