SCHEMBL595271

SCHEMBL595271

COC(=O)C1(C)CCC(C(=O)O)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.40
FFAR3 O14843 1/20 0.39
LMNA P02545 3/20 0.37
GRM2 Q14416 2/20 0.37
GRM3 Q14832 2/20 0.37
GRM4 Q14833 2/20 0.37
TSHR P16473 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP1A2 P05177 1/20 0.37
ALOX15 P16050 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GRM8 O00222 1/20 0.37
GRM6 O15303 1/20 0.37
GRM5 P41594 1/20 0.37
MTOR P42345 1/20 0.37
GRM1 Q13255 1/20 0.37
PLCB1 Q9NQ66 1/20 0.37
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35

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
SCHEMBL18169491 1.00 APLNR (0.40) APLNRFFAR3LMNAGRM2GRM3
SCHEMBL20000454 1.00 APLNR (0.40) APLNRFFAR3LMNAGRM2GRM3
SCHEMBL15248834 0.89 GRM2 (0.47) APLNRFFAR3LMNAGRM2GRM3
SCHEMBL17893129 0.89 GRM2 (0.47) APLNRFFAR3LMNAGRM2GRM3
SCHEMBL17893128 0.89 GRM2 (0.47) APLNRFFAR3LMNAGRM2GRM3
SCHEMBL16887593 0.84 TP53 (0.42) FFAR3NPSR1MAPTGAAHTT
SCHEMBL9044623 0.84 FFAR3 (0.34) FFAR3LMNANPSR1MAPTMEN1
SCHEMBL16875305 0.84 TP53 (0.42) FFAR3NPSR1MAPTGAAHTT
SCHEMBL16875576 0.84 TP53 (0.42) FFAR3NPSR1MAPTGAAHTT
SCHEMBL20855519 0.82 SMN1; SMN2 (0.40) FFAR3TDP1NPSR1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250340532-A1 HETEROCYCLIC COMPOUND CCR4 INHIBITOR AND USER THEREOF XIZANG HAISCO PHARMACEUTICAL CO LTD (CN) 2025-11-06 US disclosed
EP-4534534-A1 HETEROCYCLIC COMPOUND CCR4 INHIBITOR AND USER THEREOF Xizang Haisco Pharmaceutical Co., Ltd. (CN) 2025-04-09 EP disclosed
WO-2025059577-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS FOR USE AS AKT1 INHIBITORS ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed
WO-2023232130-A1 HETEROCYCLIC COMPOUND CCR4 INHIBITOR AND USER THEREOF 西藏海思科制药有限公司 2023-12-07 WO disclosed
EP-3240572-B1 BENZAMIDE IMIDAZOPYRAZINE BTK INHIBITORS MERCK SHARP & DOHME LLC (US) 2023-11-01 EP disclosed
US-20190119282-A1 IMIDAZOPYRIDAZINES USEFUL AS INHIBITORS OF THE PAR-2 SIGNALING PATHWAY VERTEX PHARMACEUTICALS INCORPORATED 2019-04-25 US disclosed
US-10087188-B2 Benzamide imidazopyrazine Btk inhibitors MERCK SHARP & DOHME CORP. (US) 2018-10-02 US disclosed
US-10030024-B2 Imidazopyridazines useful as inhibitors of the PAR-2 signaling pathway VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-07-24 US disclosed
WO-2018057588-A1 FURO[3,2-B]PYRIDINE COMPOUNDS USEFUL AS INHIBITORS OF THE PAR-2 SIGNALING PATHWAY VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-03-29 WO disclosed
US-20170362242-A1 BENZAMIDE IMIDAZOPYRAZINE BTK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-12-21 US disclosed
EP-1951724-A2 FUSED BICYCLIC mTOR INHIBITORS OSI Pharmaceuticals, Inc. (US) 2008-08-06 EP disclosed
US-20070280928-A1 Combined treatment with an EGFR kinase inhibitor and an agent that sensitizes tumor cells to the effects of EGFR kinase inhibitors OSI PHARMACEUTICALS, INC. 2007-12-06 US disclosed
US-20070280928-A1 Combined treatment with an EGFR kinase inhibitor and an agent that sensitizes tumor cells to the effects of EGFR kinase inhibitors OSI PHARMACEUTICALS, INC. 2007-12-06 US disclosed
WO-2007106503-A2 COMBINED TREATMENT WITH AN EGFR KINASE INHIBITOR AND AN AGENT THAT SENSITIZES TUMOR CELLS TO THE EFFECTS OF EGFR KINASE INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2007-09-20 WO disclosed
WO-2007061737-A2 FUSED BICYCLIC mTOR INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2007-05-31 WO disclosed
WO-2007061737-A2 FUSED BICYCLIC mTOR INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2007-05-31 WO disclosed
US-20070112005-A1 mammalian Target Of Rapamycin (mTOR) kinase; for treatment of lymphoma or ovarian cancer OSI PHARMACEUTICALS, INC. 2007-05-17 US disclosed
US-20070112005-A1 mammalian Target Of Rapamycin (mTOR) kinase; for treatment of lymphoma or ovarian cancer OSI PHARMACEUTICALS, INC. 2007-05-17 US disclosed
US-20070112005-A1 mammalian Target Of Rapamycin (mTOR) kinase; for treatment of lymphoma or ovarian cancer OSI PHARMACEUTICALS, INC. 2007-05-17 US disclosed
CN-1106783-A Process EASTMAN CHEM CO (US) 1995-08-16 CN 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 (7 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-20190119282-A1 IMIDAZOPYRIDAZINES USEFUL AS INHIBITORS OF THE PAR-2 SIGNALING PATHWAY F2RL1, F2R, F2RL3 APLNR 240/4885FFAR3 432/4885LMNA 1735/4885
US-20170362242-A1 BENZAMIDE IMIDAZOPYRAZINE BTK INHIBITORS BTK, SYK, ABL1 APLNR 4873/4885FFAR3 2896/4885LMNA 4305/4885
US-10087188-B2 Benzamide imidazopyrazine Btk inhibitors BTK, SYK, ABL1 APLNR 4873/4885FFAR3 2896/4885LMNA 4305/4885
US-20070280928-A1 Combined treatment with an EGFR kinase inhibitor and an agent that sensitizes tumor cells to the effects of EGFR kinase inhibitors EGFR, ERBB2, RICTOR APLNR 3516/4885FFAR3 2637/4885LMNA 4647/4885
US-20250340532-A1 HETEROCYCLIC COMPOUND CCR4 INHIBITOR AND USER THEREOF CCR4, CCR1, CCR3 APLNR 4783/4885FFAR3 1408/4885LMNA 4301/4885
US-20070112005-A1 mammalian Target Of Rapamycin (mTOR) kinase; for treatment of lymphoma or ovarian cancer MTOR, MAPKAP1, RPS6KA1 APLNR 2696/4885FFAR3 3928/4885LMNA 3837/4885
US-10030024-B2 Imidazopyridazines useful as inhibitors of the PAR-2 signaling pathway F2RL1, F2R, F2RL3 APLNR 240/4885FFAR3 432/4885LMNA 1735/4885

“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.