SCHEMBL2117317

SCHEMBL2117317

COc1cccc2c1NC(C(=O)O)C1CC=CC21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN7 P35236 13/20 1.00
▸ HSPA1A P0DMV8 9/20 1.00
▸ HSPA8 P11142 6/20 1.00
▸ TDP1 Q9NUW8 6/20 1.00
▸ GAPDH P04406 5/20 1.00
▸ KDM4E B2RXH2 4/20 1.00
▸ POLB P06746 4/20 1.00
▸ MAPT P10636 4/20 1.00
▸ HSD17B10 Q99714 4/20 1.00
▸ L3MBTL1 Q9Y468 4/20 1.00
▸ RECQL P46063 3/20 1.00
▸ BLM P54132 3/20 1.00
▸ ALDH1A1 P00352 3/20 1.00
▸ HPGD P15428 3/20 1.00
▸ THRB P10828 2/20 1.00
▸ CACNA1B Q00975 2/20 1.00
▸ APBA1 Q02410 2/20 1.00
▸ MASP2 O00187 1/20 1.00
▸ JUND P17535 1/20 1.00
▸ TNNI3 P19429 1/20 1.00

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
SCHEMBL13726132 0.83 PTPN7 (0.71) PTPN7HSPA1AHSPA8TDP1GAPDH
SCHEMBL2116061 0.82 PTPN7 (1.00) PTPN7HSPA1AHSPA8TDP1GAPDH
SCHEMBL13725202 0.82 PTPN7 (0.68) PTPN7HSPA1AHSPA8TDP1GAPDH
SCHEMBL13724800 0.82 PTPN7 (0.69) PTPN7HSPA1AHSPA8TDP1GAPDH
SCHEMBL14680373 0.81 PTPN7 (1.00) PTPN7HSPA1AHSPA8TDP1GAPDH
SCHEMBL14758490 0.81 CDC25B (1.00) PTPN7HSPA1AHSPA8TDP1GAPDH
SCHEMBL2804418 0.81 CDC25B (1.00) PTPN7HSPA1AHSPA8TDP1GAPDH
SCHEMBL13725690 0.80 PTPN7 (0.81) PTPN7HSPA1AHSPA8TDP1GAPDH
SCHEMBL10077001 0.80 MAPT (0.80) PTPN7HSPA1AHSPA8TDP1GAPDH
SCHEMBL13726071 0.79 PTPN7 (1.00) PTPN7HSPA1AHSPA8TDP1GAPDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2023-05-11 — — US disclosed
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2023-05-11 — — US disclosed
US-11584714-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-02-21 — — US disclosed
US-20120095032-A1 METHODS FOR TREATING LEUKEMIA AND MYELODYSPLASTIC SYNDROME, AND METHODS FOR IDENTIFYING AGENTS FOR TREATING SAME SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2012-04-19 — — US disclosed
US-20120095032-A1 METHODS FOR TREATING LEUKEMIA AND MYELODYSPLASTIC SYNDROME, AND METHODS FOR IDENTIFYING AGENTS FOR TREATING SAME SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2012-04-19 — — US disclosed
US-20090105240-A1 Methods for treating leukemia and myelodysplastic syndrome, and methods for identifying agents for treating same SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2009-04-23 — — US disclosed
US-20090105240-A1 Methods for treating leukemia and myelodysplastic syndrome, and methods for identifying agents for treating same SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2009-04-23 — — US disclosed
US-20090105240-A1 Methods for treating leukemia and myelodysplastic syndrome, and methods for identifying agents for treating same SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE 2009-04-23 — — 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 (4 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-11584714-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 PTPN7 1542/4885HSPA1A 3544/4885HSPA8 1921/4885
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 PTPN7 1542/4885HSPA1A 3544/4885HSPA8 1921/4885
US-20090105240-A1 Methods for treating leukemia and myelodysplastic syndrome, and methods for identifying agents for treating same MCL1, AS3MT, MYADM PTPN7 1828/4885HSPA1A 2298/4885HSPA8 2272/4885
US-20120095032-A1 METHODS FOR TREATING LEUKEMIA AND MYELODYSPLASTIC SYNDROME, AND METHODS FOR IDENTIFYING AGENTS FOR TREATING SAME MCL1, AS3MT, MYADM PTPN7 1828/4885HSPA1A 2298/4885HSPA8 2272/4885

“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.

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