SCHEMBL9825

SCHEMBL9825

CC1(C)OB(c2ccc(C3(C(=O)O)CC3)cc2)OC1(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.49
LPL P06858 8/20 0.49
P4HB P07237 1/20 0.46
F11 P03951 3/20 0.45
F2 P00734 2/20 0.45
PRSS1 P07477 2/20 0.45
PRSS2 P07478 2/20 0.45
PRSS3 P35030 2/20 0.45
AKR1C1 Q04828 1/20 0.43
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA9 Q16790 3/20 0.42
CA12 O43570 1/20 0.42
CA3 P07451 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42

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
SCHEMBL15897701 0.95 LIPG (0.57) LIPGLPLP4HBF11F2
SCHEMBL21874107 0.94 AKR1C1 (0.53) LIPGLPLP4HBF11F2
SCHEMBL9940441 0.91 ALDH1A1 (0.45) LIPGLPLP4HBF11F2
SCHEMBL14790503 0.87 LIPG (0.45) LIPGLPLP4HBF11F2
SCHEMBL3680238 0.87 F11 (0.48) LIPGLPLP4HBF11F2
SCHEMBL15912465 0.83 LIPG (0.53) LIPGLPLP4HBF11F2
SCHEMBL14709101 0.83 CA1 (0.42) LIPGLPLP4HBF11F2
SCHEMBL17215725 0.83 DGAT1 (0.53) LIPGLPL
SCHEMBL22721855 0.82 AKR1C1 (0.42) LIPGLPLP4HBF11F2
SCHEMBL14790447 0.81 LIPG (0.42) LIPGLPLP4HBF11F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12145924-B2 Lysophosphatidic acid receptor 1 (LPAR1) inhibitor compounds ELI LILLY AND COMPANY (US) 2024-11-19 US disclosed
EP-3679032-B1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS LILLY CO ELI (US) 2023-10-04 EP disclosed
US-20220281845-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS ELI LILLY AND COMPANY 2022-09-08 US disclosed
US-11365185-B2 Lysophosphatidic acid receptor 1 (LPAR1) inhibitor compounds ELI LILLY AND COMPANY (US) 2022-06-21 US disclosed
US-20200231568-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS ELI LILLY AND COMPANY 2020-07-23 US disclosed
EP-3679032-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS Eli Lilly and Company (US) 2020-07-15 EP disclosed
CN-111032647-A Lysophosphatidic acid receptor 1(LPAR1) inhibitor compounds 伊莱利利公司 2020-04-17 CN disclosed
WO-2019046239-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS ELI LILLY AND COMPANY (US) 2019-03-07 WO disclosed
US-8975235-B2 Lysophosphatidic acid receptor antagonists INTERMUNE, INC. (US) 2015-03-10 US disclosed
US-20130072449-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. (US) 2013-03-21 US disclosed
WO-2013025733-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. (US) 2013-02-21 WO disclosed
EP-2483251-A2 POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS Amira Pharmaceuticals, Inc. (US) 2012-08-08 EP disclosed
WO-2011041462-A2 POLYCYCLIC COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2011-04-07 WO disclosed
WO-2010141768-A2 POLYCYCLIC ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-12-09 WO 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 (5 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-20130072449-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR5 LIPG 97/4885LPL 111/4885P4HB 4753/4885
US-20220281845-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS LPAR1, LPAR2, LPAR5 LIPG 231/4885LPL 221/4885P4HB 4516/4885
US-12145924-B2 Lysophosphatidic acid receptor 1 (LPAR1) inhibitor compounds LPAR1, LPAR2, LPAR5 LIPG 231/4885LPL 221/4885P4HB 4516/4885
US-20200231568-A1 LYSOPHOSPHATIDIC ACID RECEPTOR 1 (LPAR1) INHIBITOR COMPOUNDS LPAR1, LPAR2, LPAR3 LIPG 224/4885LPL 210/4885P4HB 4489/4885
US-11365185-B2 Lysophosphatidic acid receptor 1 (LPAR1) inhibitor compounds LPAR1, LPAR2, LPAR3 LIPG 224/4885LPL 210/4885P4HB 4489/4885

“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.