SCHEMBL2260637

SCHEMBL2260637

Cn1cc(C(=O)O)cc(Br)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.45
ALDH1A1 P00352 3/20 0.43
MAPK10 P53779 2/20 0.43
KDM4E B2RXH2 2/20 0.40
TPMT P51580 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2D6 P10635 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.38
CREBBP Q92793 1/20 0.37
CYP3A4 P08684 1/20 0.36
MAP2K1 Q02750 1/20 0.36
KMT2A Q03164 2/20 0.36
KDM2B Q8NHM5 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
PPARG P37231 1/20 0.35
NPSR1 Q6W5P4 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
SCHEMBL924584 0.80 ALDH1A1 (0.58) ALDH1A1MAPK10KDM4ESMN1; SMN2CYP1A2
SCHEMBL24934100 0.80 BRD4 (0.44) ALDH1A1KDM4ESMN1; SMN2CYP1A2CYP2C9
SCHEMBL15230697 0.80 BRD4 (0.41) ALDH1A1KDM4ESMN1; SMN2CYP1A2CYP2C9
SCHEMBL24934110 0.79 OGG1 (0.42) ALDH1A1MAPK10KDM4ESMN1; SMN2CYP1A2
SCHEMBL480606 0.78 BRD4 (0.50)
SCHEMBL18348294 0.78 TTR (0.40) TTRALDH1A1TPMTCYP2C9CREBBP
SCHEMBL21383990 0.77 LMNA (0.41) TTRALDH1A1KDM4ETPMTSMN1; SMN2
SCHEMBL480184 0.77 TTR (0.45) TTRTPMTCYP2C9CREBBPKMT2A
SCHEMBL15228321 0.77 TPMT (0.47) TPMTCYP2C9CREBBPMAP2K1KMT2A
SCHEMBL21224824 0.76 BRD4 (0.43) ALDH1A1MAPK10KDM4EHSD17B10CREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230077268-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. 2023-03-09 US disclosed
US-11427558-B1 Indazoles and azaindazoles as LRRK2 inhibitors ESCAPE Bio, Inc. (US) 2022-08-30 US disclosed
EP-3997081-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS Escape Bio, Inc. (US) 2022-05-18 EP disclosed
CN-114450274-A Indazoles and azaindazoles as LRRK2 inhibitors 伊斯凯普生物公司 2022-05-06 CN disclosed
WO-2021007477-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2021-01-14 WO disclosed
WO-2021007477-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS E-SCAPE BIO, INC. (US) 2021-01-14 WO disclosed
EP-2860178-B1 P2X3 receptor antagonists for treatment of pain MERCK SHARP & DOHME (US) 2021-01-13 EP disclosed
EP-2860178-A2 P2X3 receptor antagonists for treatment of pain Merck Sharp & Dohme Corp. (US) 2015-04-15 EP disclosed
US-8598209-B2 P2X3, receptor antagonists for treatment of pain MERCK SHARP & DOHME CORP. (US) 2013-12-03 US disclosed
US-20110206783-A1 P2X3, RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN MERCK SHARP & DOHME LLC 2011-08-25 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 (3 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-11427558-B1 Indazoles and azaindazoles as LRRK2 inhibitors LRRK2, PARK7, GDI2 TTR 4806/4885ALDH1A1 1904/4885MAPK10 1024/4885
US-20110206783-A1 P2X3, RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN P2RX3, P2RX1, P2RX2 TTR 4350/4885ALDH1A1 2798/4885MAPK10 2257/4885
US-20230077268-A1 INDAZOLES AND AZAINDAZOLES AS LRRK2 INHIBITORS LRRK2, PARK7, GDI2 TTR 4806/4885ALDH1A1 1904/4885MAPK10 1024/4885

“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.