SCHEMBL15819861

SCHEMBL15819861

Cc1c(CC(=O)O)cccc1[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
TDP1 Q9NUW8 3/20 0.58
SMN1; SMN2 Q16637 4/20 0.53
CYP1A2 P05177 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
POLB P06746 4/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
LMNA P02545 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
ALDH1A1 P00352 3/20 0.47
CYP2C19 P33261 2/20 0.47
CYP2C9 P11712 1/20 0.47
CYP3A4 P08684 1/20 0.46
BLM P54132 1/20 0.45

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
SCHEMBL1294540 1.00 TSHR (0.58) TSHRTDP1SMN1; SMN2CYP1A2L3MBTL1
SCHEMBL5506551 0.85 TDP1 (0.56) TSHRTDP1SMN1; SMN2L3MBTL1POLB
SCHEMBL19181026 0.85 CYP1A2 (0.57) TSHRTDP1SMN1; SMN2CYP1A2L3MBTL1
SCHEMBL29926354 0.85 CYP1A2 (0.57) TSHRTDP1SMN1; SMN2CYP1A2L3MBTL1
SCHEMBL74692 0.82 CYP1A2 (0.62) TSHRSMN1; SMN2CYP1A2L3MBTL1POLB
SCHEMBL3727437 0.81 TDP1 (0.51) TSHRTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL7634893 0.81 TSHR (0.53) TSHRTDP1SMN1; SMN2CYP1A2L3MBTL1
Acetic Acid SCHEMBL9323112 0.81 CYP1A2 (0.57) TSHRSMN1; SMN2CYP1A2L3MBTL1POLB
SCHEMBL3953258 0.81 GPR35 (0.60) TSHRTDP1CYP1A2L3MBTL1MEN1
SCHEMBL4388496 0.81 GPR35 (0.53) TSHRTDP1SMN1; SMN2CYP1A2L3MBTL1

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
CN-119768164-A Pharmaceutical compounds for treating complement-mediated disorders 阿雷克森制药公司 2025-04-04 CN disclosed
EP-2934533-B1 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME (US) 2017-11-15 EP disclosed
US-9573961-B2 Inhibitors of the renal outer medullary potassium channel MERCK SHARP & DOHME CORP. (US) 2017-02-21 US disclosed
US-20150329557-A1 Inhibitors of the Renal Outer Medullary Potassium Channel MERCK SHARP & DOHME CORP. (US) 2015-11-19 US disclosed
EP-2934533-A2 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL Merck Sharp & Dohme Corp. (US) 2015-10-28 EP disclosed
WO-2014099633-A2 INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL MERCK SHARP & DOHME CORP. (US) 2014-06-26 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 (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-20150329557-A1 Inhibitors of the Renal Outer Medullary Potassium Channel KCNJ11, KCNJ1, KCNJ2 TSHR 1548/4885TDP1 3485/4885SMN1; SMN2 1689/4885

“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.