SCHEMBL6325442

SCHEMBL6325442

CCCCNc1cccc(C(=O)O)c1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.58
NR1H4 Q96RI1 6/20 0.56
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.52
HPGD P15428 1/20 0.52
F2R P25116 2/20 0.52
HCAR3 P49019 2/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51

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
SCHEMBL9231035 0.95 NR1H4 (0.56) AKR1C3NR1H4F2RHCAR3HDAC11
SCHEMBL6330083 0.94 HDAC11 (0.58) AKR1C3NR1H4HCAR3HDAC11HDAC8
SCHEMBL6330053 0.94 HDAC11 (0.58) AKR1C3NR1H4HCAR3HDAC11HDAC8
SCHEMBL21940532 0.94 HDAC11 (0.58) AKR1C3NR1H4HCAR3HDAC11HDAC8
SCHEMBL30012465 0.94 HDAC11 (0.58) AKR1C3NR1H4HCAR3HDAC11HDAC8
SCHEMBL6332453 0.94 HDAC11 (0.58) AKR1C3NR1H4HCAR3HDAC11HDAC8
SCHEMBL873032 0.90 AKR1C3 (0.61) AKR1C3NR1H4SMN1; SMN2HCAR3
SCHEMBL11070287 0.86 SOAT2 (0.52) AKR1C3NR1H4HCAR3HDAC11HDAC8
SCHEMBL11070282 0.86 SOAT2 (0.52) AKR1C3NR1H4HCAR3HDAC11HDAC8
SCHEMBL11065030 0.86 SOAT2 (0.52) AKR1C3NR1H4HDAC11HDAC8

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-20230250106-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-10 US disclosed
WO-2021093817-A1 IMMUNOMODULATORY COMPOUNDS, COMPOSITION AND APPLICATION THEREOF 杭州和正医药有限公司 2021-05-20 WO disclosed
US-6858565-B2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2005-02-22 US disclosed
US-20030040434-A1 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2003-02-27 US disclosed
EP-1264707-A2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2002-12-11 EP disclosed
US-3985777-A Sulphamyl-benzoic acid derivatives LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB (DK) 1976-10-12 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 (1 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-20230250106-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 AKR1C3 4665/4885NR1H4 2695/4885SMN1; SMN2 2298/4885

“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.