SCHEMBL13601620

SCHEMBL13601620

Cc1cccc(B2OC(C)(C)C(C)(C)O2)c1F

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPL P06858 10/20 0.41
LIPG Q9Y5X9 10/20 0.41
JAK2 O60674 3/20 0.40
BTK Q06187 3/20 0.40
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
ACHE P22303 1/20 0.31
P2RX7 Q99572 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.30
CXCR2 P25025 1/20 0.30

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
SCHEMBL24630498 0.88 LPL (0.46) LPLLIPGJAK2BTKCA1
SCHEMBL1477654 0.85 LPL (0.43) LPLLIPGJAK2BTKCA1
SCHEMBL2301628 0.83 JAK2 (0.43) LPLLIPGJAK2BTKCA1
SCHEMBL14878282 0.81 JAK2 (0.41) LPLLIPGJAK2BTKP2RX7
SCHEMBL6686927 0.80 LPL (0.47) LPLLIPGJAK2BTKACHE
SCHEMBL1494570 0.80 LPL (0.40) LPLLIPGJAK2BTKCA1
SCHEMBL16816010 0.80 JAK2 (0.41) LPLLIPGJAK2BTK
SCHEMBL23756192 0.80 LPL (0.40) LPLLIPGJAK2BTKCA1
SCHEMBL31440036 0.79 LPL (0.39) LPLLIPGJAK2BTK
SCHEMBL4879042 0.79 LPL (0.39) LPLLIPGJAK2BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230322675-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH LPA RECEPTOR ACTIVITY LHOTSE BIO, INC. 2023-10-12 US disclosed
US-20090298894-A1 AMINO ACID COMPOUNDS ASAHI KASEI PHARMA CORPORATION (JP) 2009-12-03 US disclosed
US-20090298894-A1 AMINO ACID COMPOUNDS ASAHI KASEI PHARMA CORPORATION (JP) 2009-12-03 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-20230322675-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH LPA RECEPTOR ACTIVITY LPAR2, LPAR1, LPAR6 LPL 11/4885LIPG 22/4885JAK2 1769/4885
US-20090298894-A1 AMINO ACID COMPOUNDS S1PR1, S1PR2, S1PR5 LPL 2323/4885LIPG 1130/4885JAK2 860/4885

“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.