SCHEMBL30344752

SCHEMBL30344752

N#CC1(c2cccc3ccccc23)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.46
SLC6A3 Q01959 8/20 0.45
SLC6A4 P31645 7/20 0.45
SLC6A2 P23975 6/20 0.45
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
OPRM1 P35372 1/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP2A6 P11509 3/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL8747153 1.00 OPRL1 (0.46) OPRL1SLC6A3SLC6A4SLC6A2KDM4E
SCHEMBL8107135 0.93 SLC6A3 (0.46) OPRL1SLC6A3SLC6A4SLC6A2KDM4E
SCHEMBL15863052 0.93 SLC6A3 (0.50) OPRL1SLC6A3SLC6A4SLC6A2KDM4E
SCHEMBL3518098 0.91 SLC6A3 (0.53) OPRL1SLC6A3SLC6A4SLC6A2KDM4E
Hydrochloric Acid SCHEMBL28838664 0.87 KDM4E (0.41) OPRL1SLC6A3SLC6A4SLC6A2KDM4E
SCHEMBL11825567 0.87 CA1 (0.40) OPRL1SLC6A3SLC6A4SLC6A2KDM4E
SCHEMBL10526403 0.81 OPRM1 (0.39) MEN1KMT2ACA1CA2OPRM1
SCHEMBL17187826 0.80 IDO1 (0.39) OPRL1OPRM1ALDH1A1CYP2A6CYP1A2
SCHEMBL17187805 0.80 CYP2A6 (0.36) OPRL1SLC6A3SLC6A4SLC6A2MAPT
SCHEMBL17187921 0.80 IDO1 (0.39) OPRL1OPRM1ALDH1A1CYP2A6CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES Clear Creek Bio, Inc. (US) 2025-01-23 US disclosed
WO-2023064493-A1 COMPOUNDS AND METHODS FOR TREATING CORONAVIRUSES Clear Creek Bio, Inc. (US) 2023-04-20 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-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES ACE, PREP, PEPD OPRL1 2888/4885SLC6A3 4304/4885SLC6A4 3618/4885

“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.