SCHEMBL19651997

SCHEMBL19651997

CCCCC(C)(CCC)C(=O)OCC1CO1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
ENPP2 Q13822 1/20 0.34
LPAR2 Q9HBW0 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
SCHEMBL12900126 0.94 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL21769282 0.93 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL9952240 0.91 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL25797198 0.88 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL10773349 0.87 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL12026823 0.84 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL16543533 0.83 CA1 (0.35) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL16543536 0.82 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL28804165 0.81 SMN1; SMN2 (0.39) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4
SCHEMBL14977243 0.81 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TDP1TP53CYP3A4

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
US-10815186-B2 Preparation of vegetable oil-based monomers for use in thermosetting resins WASHINGTON STATE UNIVERSITY (US) 2020-10-27 US disclosed
US-10752803-B2 1K high hardness, high impact resistance coating THE SHERWIN-WILLIAMS COMPANY (US) 2020-08-25 US disclosed
US-20200062688-A1 PREPARATION OF VEGETABLE OIL-BASED MONOMERS FOR USE IN THERMOSETTING RESINS WASHINGTON STATE UNIVERSITY 2020-02-27 US disclosed
US-20190085202-A1 1K HIGH HARDNESS, HIGH IMPACT RESISTANCE COATING THE SHERWIN-WILLIAMS COMPANY (US) 2019-03-21 US disclosed
US-20170342296-A1 1K 100% SOLIDS DRY-ERASE COATING COMPOSITION THE SHERWIN-WILLIAMS COMPANY (US) 2017-11-30 US disclosed
US-20170342296-A1 1K 100% SOLIDS DRY-ERASE COATING COMPOSITION THE SHERWIN-WILLIAMS COMPANY (US) 2017-11-30 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-20200062688-A1 PREPARATION OF VEGETABLE OIL-BASED MONOMERS FOR USE IN THERMOSETTING RESINS FASN, REV1, WDR48 ALDH1A1 3392/4885SMN1; SMN2 1185/4885TDP1 2394/4885
US-10815186-B2 Preparation of vegetable oil-based monomers for use in thermosetting resins FASN, REV1, WDR48 ALDH1A1 3392/4885SMN1; SMN2 1185/4885TDP1 2394/4885

“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.