SCHEMBL1573370

SCHEMBL1573370

Cc1cc(C)cc([C@@H](O)C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
MAPK1 P28482 1/20 0.50
TPMT P51580 1/20 0.46
BLM P54132 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
TSHR P16473 1/20 0.43
PTGS2 P35354 1/20 0.39
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
ALDH1A1 P00352 1/20 0.36
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
AKR1C3 P42330 2/20 0.36
AKR1C2 P52895 2/20 0.36
HCAR1 Q9BXC0 1/20 0.35
KMT2A Q03164 2/20 0.34
POLB P06746 1/20 0.34
PKM P14618 1/20 0.34
PTPN1 P18031 1/20 0.34

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
SCHEMBL6397570 1.00 LMNA (0.50) LMNAMAPK1TPMTBLMNPSR1
SCHEMBL1573368 1.00 LMNA (0.50) LMNAMAPK1TPMTBLMNPSR1
SCHEMBL13238635 0.86 LMNA (0.42) LMNAMAPK1TPMTBLMNPSR1
SCHEMBL13979380 0.86 LMNA (0.42) LMNAMAPK1TPMTBLMNPSR1
SCHEMBL12588339 0.86 LMNA (0.42) LMNAMAPK1TPMTBLMNPSR1
SCHEMBL23973511 0.81 TAS2R14 (0.40) LMNAMAPK1RXRARXRBAKR1C3
SCHEMBL1573058 0.79 LMNA (0.48) LMNAMAPK1BLMNPSR1TSHR
SCHEMBL1573057 0.79 LMNA (0.48) LMNAMAPK1BLMNPSR1TSHR
SCHEMBL31407019 0.79 LMNA (0.59) LMNAMAPK1BLMNPSR1TSHR
SCHEMBL2164471 0.79 LMNA (0.59) LMNAMAPK1BLMNPSR1TSHR

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
US-20050090478-A1 Platinum complexes and their use in cancer treatment YISSUM RESEARCH DEVELOPMENT COMPANY OF THE (IL) 2005-04-28 US claimed
US-8044067-B2 Isoquinolines as IGF-1R inhibitors ANALYTECON S.A. (CH) 2011-10-25 US disclosed
EP-1931636-B1 ISOQUINOLINES AS IGF-1R INHIBITORS ANALYTECON SA (CH) 2011-04-13 EP disclosed
US-6921758-B2 Amino acid derivatives ASTRAZENECA AB (SE) 2005-07-26 US disclosed
US-20040087647-A1 NEW AMINO ACID DERIVATIVES ASTRAZENECA AB 2004-05-06 US disclosed
US-6617320-B2 Protease inhibitor; anticoagulants ASTRAZENECA AB (SE) 2003-09-09 US disclosed
EP-0836615-B1 NEW THROMBIN INHIBITORS, THEIR PREPARATION AND USE ASTRAZENECA AB (SE) 2003-04-23 EP disclosed
US-20020042396-A1 Amino acid derivatives ASTRA AB 2002-04-11 US disclosed
US-6337343-B1 TREATMENT OF THROMBOSIS WITH ANTICOAGULANTS ASTRAZENECA AB (SE) 2002-01-08 US disclosed
US-6051568-A Thrombin inhibitors, their preparation and use ASTRA AKTIEBOLAG (SE) 2000-04-18 US disclosed
EP-0836615-A1 NEW THROMBIN INHIBITORS, THEIR PREPARATION AND USE Astra Aktiebolag (SE) 1998-04-22 EP disclosed
WO-1997002284-A1 NEW THROMBIN INHIBITORS, THEIR PREPARATION AND USE ASTRA AKTIEBOLAG (SE) 1997-01-23 WO disclosed
US-4218380-A OXIDATION OF THE A-HYDROXY-ARYLACETIC ACID BAYER AKTIENGESELLSCHAFT (DE) 1980-08-19 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 (3 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-20050090478-A1 Platinum complexes and their use in cancer treatment PAICS, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, PIN1 LMNA 3495/4885MAPK1 4630/4885TPMT 1439/4885
US-20020042396-A1 Amino acid derivatives F2, SERPINC1, ARGLU1 LMNA 3361/4885MAPK1 1223/4885TPMT 1812/4885
US-20040087647-A1 NEW AMINO ACID DERIVATIVES F2, ANPEP, PEPD LMNA 2654/4885MAPK1 1138/4885TPMT 2142/4885

“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.