SCHEMBL4454199

SCHEMBL4454199

CCOC(=O)C1CCCN1O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 2/20 0.49
ALDH1A1 P00352 10/20 0.45
MAPT P10636 2/20 0.44
KDM4E B2RXH2 6/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
RECQL P46063 1/20 0.41
HTT P42858 1/20 0.40

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
SCHEMBL4892941 1.00 FKBP1A (0.49) FKBP1AALDH1A1MAPTKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL953015 0.98 FKBP1A (0.48) FKBP1AALDH1A1MAPTKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL5980951 0.98 FKBP1A (0.48) FKBP1AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL4202767 0.83 FKBP1A (0.44) FKBP1AALDH1A1SMN1; SMN2
SCHEMBL2731647 0.83 FKBP1A (0.44) FKBP1AALDH1A1SMN1; SMN2
SCHEMBL11490824 0.81 FKBP1A (0.49) FKBP1AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL13601738 0.81 FKBP1A (0.49) FKBP1AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL11490823 0.81 FKBP1A (0.49) FKBP1AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL4893219 0.81 RAB9A (0.55) ALDH1A1MAPTKDM4ETSHRHTT
SCHEMBL5065864 0.80 CHRM2 (0.43) FKBP1AMAPTTSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080176923-A1 Proline Derivatives Used as Pharmaceutical Active Ingredients for the Treatment of Tumors SALAMA ZOSER B 2008-07-24 US claimed
US-20070021330-A1 Aza-peptide macrocyclic hepatitis c serine protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2007-01-25 US claimed
US-7125845-B2 Aza-peptide macrocyclic hepatitis C serine protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2006-10-24 US claimed
US-20050065073-A1 Aza-peptide macrocyclic hepatitis C serine protease inhibitors ENANTA PHARMACEUTICALS, INC. 2005-03-24 US claimed
WO-2005010029-A1 AZA-PEPTIDE MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2005-02-03 WO claimed
EP-0656026-B1 POLYARYLATES CONTAINING DERIVATIVES OF THE NATURAL AMINO ACID L-TYROSINE UNIV RUTGERS (US) 1999-11-17 EP claimed
EP-0656026-A4 POLYARYLATES CONTAINING DERIVATIVES OF THE NATURAL AMINO ACID L-TYROSINE. UNIV RUTGERS (US) 1996-01-10 EP claimed
EP-0656026-A1 POLYARYLATES CONTAINING DERIVATIVES OF THE NATURAL AMINO ACID L-TYROSINE RUTGERS, THE STATE UNIVERSITY (US) 1995-06-07 EP claimed
WO-1994004593-A1 POLYARYLATES CONTAINING DERIVATIVES OF THE NATURAL AMINO ACID L-TYROSINE RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 1994-03-03 WO claimed
US-5216115-A Molded articles and drug delivery systems RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 1993-06-01 US claimed
CN-106946867-B FXR receptor modulators and its preparation method and application 广州市恒诺康医药科技有限公司 2019-11-12 CN disclosed
US-7485662-B2 Therapeutic agent for diabetes mellitus KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-02-03 US disclosed
US-20080176923-A1 Proline Derivatives Used as Pharmaceutical Active Ingredients for the Treatment of Tumors SALAMA ZOSER B 2008-07-24 US disclosed
US-20070167512-A1 Lipid metabolism improving agent KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-19 US disclosed
US-20060173066-A1 Remedy for diabetes KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-08-03 US disclosed
EP-0656026-A1 POLYARYLATES CONTAINING DERIVATIVES OF THE NATURAL AMINO ACID L-TYROSINE RUTGERS, THE STATE UNIVERSITY (US) 1995-06-07 EP disclosed
US-5405847-A Antiallergic, antiasthmatic, anxiolytic, hypotensive agents ASTA MEDICA AKTIENGESELLSCHAFT (DE) 1995-04-11 US disclosed
US-5317077-A Polyarylates containing derivatives of the natural amino acid l-tyrosine RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 1994-05-31 US disclosed
WO-1994004593-A1 POLYARYLATES CONTAINING DERIVATIVES OF THE NATURAL AMINO ACID L-TYROSINE RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 1994-03-03 WO disclosed
US-5216115-A Molded articles and drug delivery systems RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 1993-06-01 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 (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-20070021330-A1 Aza-peptide macrocyclic hepatitis c serine protease inhibitors VIP, CTSC, DPP4 FKBP1A 434/4885ALDH1A1 2329/4885MAPT 4684/4885
US-20050065073-A1 Aza-peptide macrocyclic hepatitis C serine protease inhibitors VIP, CTSC, PRSS1 FKBP1A 407/4885ALDH1A1 2265/4885MAPT 4748/4885
US-20080176923-A1 Proline Derivatives Used as Pharmaceutical Active Ingredients for the Treatment of Tumors PREP, PRAP1, VHL FKBP1A 253/4885ALDH1A1 1543/4885MAPT 3804/4885
US-20070167512-A1 Lipid metabolism improving agent LIPC, LIPA, FABP1 FKBP1A 3538/4885ALDH1A1 282/4885MAPT 3382/4885
US-20060173066-A1 Remedy for diabetes IAPP, GPR119, SLC5A1 FKBP1A 1548/4885ALDH1A1 300/4885MAPT 3277/4885

“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.