SCHEMBL4965566

SCHEMBL4965566

CC1(C=CC(=O)O)CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
TSHR P16473 2/20 0.35
TP53 P04637 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
EGLN3 Q9H6Z9 1/20 0.35
FFAR3 O14843 1/20 0.33
UGT2B7 P16662 2/20 0.33
RXRA P19793 2/20 0.33
RXRB P28702 2/20 0.33
RXRG P48443 2/20 0.33
RARB P10826 1/20 0.33
RARG P13631 1/20 0.33
GAA P10253 2/20 0.31
HTT P42858 1/20 0.31
NPC1 O15118 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP2C19 P33261 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL14400223 1.00 CYP1A2 (0.38) CYP1A2TSHRTP53EGLN1EGLN3
SCHEMBL10702869 1.00 CYP1A2 (0.38) CYP1A2TSHRTP53EGLN1EGLN3
SCHEMBL101808 0.98 CYP1A2 (0.39) CYP1A2TSHRTP53EGLN1EGLN3
SCHEMBL2772093 0.78 CYP1A2 (0.33) CYP1A2TSHRTP53EGLN1EGLN3
SCHEMBL11117626 0.74 CYP2C19 (0.37) CYP1A2TSHRTP53EGLN1EGLN3
SCHEMBL10616734 0.74 PTPN2 (0.34)
SCHEMBL10616731 0.74 PTPN2 (0.34)
SCHEMBL1069247 0.74 CYP1A2 (0.36) CYP1A2TSHRTP53EGLN1EGLN3
SCHEMBL2162852 0.74 HCAR2 (0.33) CYP1A2TSHRTP53EGLN1EGLN3
SCHEMBL22734220 0.74 HCAR2 (0.47) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4001345-B1 DEGRADABLE HYPERBRANCHED RESIN, PREPARATION METHOD THEREFOR, AND USE THEREOF UNIV SOUTH CHINA TECH (CN) 2026-04-01 EP claimed
US-11485725-B2 Derivatives of piperlongumine and uses thereof AURANSA INC. (US) 2022-11-01 US disclosed
EP-1314725-B1 SULFONIUM SALT COMPOUND WAKO PURE CHEM IND LTD (JP) 2008-03-19 EP disclosed
US-6924323-B2 Sulfonium salt compound WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-02 US disclosed
EP-1427763-A1 METHOD FOR THE PRODUCTION OF POLYMERS AND COPOLYMERS FROM ACRYLIC COMPOUNDS Röhm GmbH & Co. KG (DE) 2004-06-16 EP disclosed
US-6723483-B1 Sulfonium salt compounds WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2004-04-20 US disclosed
US-20040033434-A1 Sulfonium salt compound FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2004-02-19 US disclosed
WO-2003048176-A1 CATALYST FOR PRODUCING (CO)POLYMERS OF (METH)ACRYLIC COMPOUNDS Röhm GmbH & Co. KG (DE) 2003-06-12 WO disclosed
EP-1314725-A1 SULFONIUM SALT COMPOUND Wako Pure Chemical Industries, Ltd. (JP) 2003-05-28 EP disclosed
WO-2003022897-A1 METHOD FOR THE PRODUCTION OF POLYMERS AND COPOLYMERS FROM ACRYLIC COMPOUNDS Röhm GmbH & Co. KG (DE) 2003-03-20 WO disclosed
EP-0130451-B1 COATING PREPARATION PROCESS BASF Aktiengesellschaft (DE) 1988-03-30 EP 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 (2 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-11485725-B2 Derivatives of piperlongumine and uses thereof PIR, THPO, DHPS CYP1A2 380/4885TSHR 4431/4885TP53 172/4885
US-20040033434-A1 Sulfonium salt compound SPIN1, RER1, SPIN2B CYP1A2 1973/4885TSHR 2324/4885TP53 4109/4885

“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.