SCHEMBL29519612

SCHEMBL29519612

CC(C)=CCC/C(C)=C/CCC1(C)C=Cc2c(O)cc(C)c(C=O)c2O1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 2/20 0.64
▸ PTPN1 P18031 2/20 0.58
▸ NR1H4 Q96RI1 4/20 0.55
▸ BACE1 P56817 1/20 0.55
▸ ALOX5 P09917 2/20 0.51
▸ PTGS1 P23219 1/20 0.51
▸ BCHE P06276 2/20 0.47
▸ TRPA1 O75762 1/20 0.47
▸ LDHA P00338 1/20 0.47
▸ CNR1 P21554 1/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ SLC6A4 P31645 1/20 0.47
▸ CNR2 P34972 1/20 0.47
▸ SLC6A3 Q01959 1/20 0.47
▸ TRPM8 Q7Z2W7 1/20 0.47
▸ TRPV1 Q8NER1 1/20 0.47
▸ TRPV3 Q8NET8 1/20 0.47
▸ TRPV4 Q9HBA0 1/20 0.47
▸ TRPV2 Q9Y5S1 1/20 0.47
▸ MAPT P10636 3/20 0.46

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
SCHEMBL10603080 0.79 APP (0.62) APPPTPN1NR1H4BACE1ALOX5
Confluentin SCHEMBL29636442 0.78 APP (1.00) APPPTPN1NR1H4BACE1ALOX5
Confluentin SCHEMBL31544928 0.78 APP (1.00) APPPTPN1NR1H4BACE1ALOX5
Confluentin SCHEMBL31545320 0.78 APP (1.00) APPPTPN1NR1H4BACE1ALOX5
Confluentin SCHEMBL31545250 0.78 APP (1.00) APPPTPN1NR1H4BACE1ALOX5
SCHEMBL27160317 0.78 APP (0.63) APPPTPN1NR1H4BACE1ALOX5
SCHEMBL27160318 0.78 APP (0.63) APPPTPN1NR1H4BACE1ALOX5
SCHEMBL27160316 0.78 APP (0.63) APPPTPN1NR1H4BACE1ALOX5
SCHEMBL27414830 0.78 APP (0.63) APPPTPN1NR1H4BACE1ALOX5
SCHEMBL21710551 0.77 PTPN1 (0.64) APPPTPN1ALOX5PTGS1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4065981-A1 BIOMARKERS FOR DETECTING COLORECTAL CANCER OR ADENOMA AND METHODS THEREOF Precogify Pharmaceutical China Co., Ltd. (CN) 2022-10-05 — — EP disclosed
US-11462305-B2 Biomarkers for detecting colorectal cancer or adenoma and methods thereof Precogify Pharmaceutical China Co., Ltd. (CN) 2022-10-04 — — US disclosed
US-20220108777-A1 BIOMARKERS FOR DETECTING COLORECTAL CANCER OR ADENOMA AND METHODS THEREOF Precogify Pharmaceutical China Co., Ltd. (CN) 2022-04-07 — — US disclosed
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