SCHEMBL704205

SCHEMBL704205

CCCCCC1=CCC(=O)O1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.34
BACE1 P56817 1/20 0.34
CDC25A P30304 6/20 0.34
CDC25B P30305 6/20 0.34
CDC25C P30307 5/20 0.34
ALOX15 P16050 1/20 0.33
GPR84 Q9NQS5 3/20 0.33
CYP1A2 P05177 3/20 0.33
KMT2A Q03164 1/20 0.32
CYP1A1 P04798 1/20 0.31
MAPT P10636 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 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
SCHEMBL2315804 0.98 ACHE (0.37) ACHEBACE1CDC25ACDC25BCDC25C
SCHEMBL4629705 0.98 ACHE (0.37) ACHEBACE1CDC25ACDC25BCDC25C
SCHEMBL3021386 0.98 ACHE (0.37) ACHEBACE1CDC25ACDC25BCDC25C
Hexanoate SCHEMBL27802806 0.87 SCD (0.51) CDC25ACDC25BCDC25CALOX15GPR84
SCHEMBL7054062 0.81 CYP1A2 (0.34) ACHEBACE1CDC25ACDC25BCDC25C
SCHEMBL9992284 0.79 FNTA (0.37)
SCHEMBL28600201 0.79 CDC25A (0.34) ACHEBACE1CDC25ACDC25BCDC25C
SCHEMBL11156027 0.76 ACHE (0.37) ACHEBACE1CDC25ACDC25BCDC25C
SCHEMBL9264130 0.74 ACHE (0.40) ACHEBACE1CDC25ACDC25BCDC25C
SCHEMBL5821421 0.74 CYP1A1 (0.33) ACHEBACE1GPR84CYP1A2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9084827-B2 Biodegradable polyurethane/urea compositions POLYNOVO BIOMATERIALS PTY LIMITED (AU) 2015-07-21 US claimed
US-20140099277-A1 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS POLYNOVO BIOMATERIALS PTY LIMITED (AU) 2014-04-10 US claimed
US-20130150964-A1 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS POLYNOVO BIOMATERIALS PTY LIMITED (AU) 2013-06-13 US claimed
US-7105628-B2 Compositions for golf equipment ACUSHNET COMPANY (US) 2006-09-12 US claimed
US-20040220378-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-04 US claimed
WO-2026087386-A1 ROSIN DIESTER COMPOUNDS AND USES THEREOF FIRMENICH SA (CH) 2026-04-30 WO disclosed
EP-4680039-A1 COMPOSITIONS FOR REDUCING OFF NOTES AND USES THEREOF DSM-Firmenich AG (CH) 2026-01-21 EP disclosed
US-20250387310-A1 COMPOSITIONS THAT ENHANCE THE COOLING EFFECT FIRMENICH INCORPORATED (US) 2025-12-25 US disclosed
EP-4661972-A1 TASTE-MODIFYING COMPOSITIONS AND USES THEREOF Firmenich SA (CH) 2025-12-17 EP disclosed
WO-2025202256-A1 COOLING COMPOSITION FIRMENICH SA (CH) 2025-10-02 WO disclosed
EP-4608171-A1 NATURAL SWEETENER COMPOSITIONS CONTAINING ALKYL LACTATES AND USES THEREOF Firmenich SA (CH) 2025-09-03 EP disclosed
EP-3164107-B1 LACTONE-CONTAINING COMPOSITIONS FOR MALODOR ELIMINATION TAKASAGO PERFUMERY CO LTD (JP) 2025-09-03 EP disclosed
US-20040220356-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-04 US disclosed
US-20040220378-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-04 US disclosed
US-20040220377-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-04 US disclosed
US-20040220373-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-04 US disclosed
US-20040220376-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-04 US disclosed
US-20040220371-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-04 US disclosed
US-20040220357-A1 Compositions for golf equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-04 US disclosed
US-4435329-A ANTIHYPERTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1984-03-06 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-20140099277-A1 BIODEGRADABLE POLYURETHANE/UREA COMPOSITIONS PUF60, UMPS, COL2A1 ACHE 4303/4885BACE1 4733/4885CDC25A 3086/4885
US-20250387310-A1 COMPOSITIONS THAT ENHANCE THE COOLING EFFECT TAS2R30, TAS2R1, TAS2R20 ACHE 793/4885BACE1 927/4885CDC25A 3441/4885

“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.