SCHEMBL21798467

SCHEMBL21798467

Cc1cccc(OCc2ccc(C(=O)O)cc2)c1C=O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 9/20 0.70
RXRB P28702 8/20 0.70
RXRG P48443 7/20 0.70
HPGD P15428 2/20 0.55
MAPT P10636 3/20 0.53
RAB9A P51151 2/20 0.53
LMNA P02545 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
FOLH1 Q04609 1/20 0.53
PTGER1 P34995 1/20 0.49
PTGER4 P35408 1/20 0.49
PTGER3 P43115 1/20 0.49
PTGER2 P43116 1/20 0.49
KDM4E B2RXH2 2/20 0.48
KMT2A Q03164 2/20 0.48
PSMD14 O00487 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CRHBP P24387 1/20 0.48
PPARG P37231 1/20 0.48
CRHR2 Q13324 1/20 0.48

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
SCHEMBL15125899 0.89 RXRA (0.50) RXRARXRBRXRGHPGDMAPT
SCHEMBL21798491 0.87 RAB9A (0.72) RXRARXRBRXRGMAPTRAB9A
SCHEMBL19543235 0.87 RXRA (0.52) RXRARXRBRXRGHPGDMAPT
SCHEMBL23383976 0.86 RXRA (0.70) RXRARXRBRXRGHPGDMAPT
SCHEMBL2579088 0.86 MAPT (0.59) RXRARXRBRXRGMAPTRAB9A
Tucaresol SCHEMBL29400654 0.85 RXRA (0.56) RXRARXRBRXRGHPGDMAPT
Tucaresol SCHEMBL600942 0.85 RXRA (0.56) RXRARXRBRXRGHPGDMAPT
SCHEMBL17664765 0.84 MAOB (0.52) RXRARXRBRXRGHPGDMAPT
SCHEMBL30495975 0.84 RXRA (0.56) RXRARXRBRXRGHPGDMAPT
SCHEMBL23363642 0.84 RXRA (0.56) RXRARXRBRXRGHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4328046-A1 NITRILE OXIDE COMPOUND AND IONIC-FUNCTIONAL-GROUP-CONTAINING POLYMER Sumitomo Rubber Industries, Ltd. (JP) 2024-02-28 EP disclosed
WO-2022244317-A1 NITRILE OXIDE COMPOUND AND IONIC-FUNCTIONAL-GROUP-CONTAINING POLYMER 住友ゴム工業株式会社 2022-11-24 WO disclosed
US-10875949-B2 Polymerizable materials based on dimerizable benzaldehyde derivatives IVOCLAR VIVADENT AG (LI) 2020-12-29 US disclosed
US-10875949-B2 Polymerizable materials based on dimerizable benzaldehyde derivatives IVOCLAR VIVADENT AG (LI) 2020-12-29 US disclosed
EP-3622943-A1 POLYMERISABLE MATERIALS BASED ON DIMERISATION-CAPABLE BENZALDEHYDE DERIVATIVES Ivoclar Vivadent AG (LI) 2020-03-18 EP disclosed
US-20200079888-A1 Polymerizable Materials Based On Dimerizable Benzaldehyde Derivatives IVOCLAR VIVADENT AG (LI) 2020-03-12 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 (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-20200079888-A1 Polymerizable Materials Based On Dimerizable Benzaldehyde Derivatives FANCI, CAD, ALDH1A2 RXRA 2935/4885RXRB 2812/4885RXRG 3028/4885
US-10875949-B2 Polymerizable materials based on dimerizable benzaldehyde derivatives FANCI, CAD, ALDH1A2 RXRA 2935/4885RXRB 2812/4885RXRG 3028/4885

“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.