SCHEMBL25310751

SCHEMBL25310751

OCCC1CCCCCCCCCCCCCC1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.48
SIGMAR1 Q99720 3/20 0.44
ESR2 Q92731 2/20 0.44
HPGD P15428 1/20 0.41
METAP1 P53582 1/20 0.40
EPHX1 P07099 1/20 0.39
CHRM5 P08912 2/20 0.36
ADRA2C P18825 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM1 P11229 1/20 0.36

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
SCHEMBL1240639 1.00 CYP1A2 (0.48) CYP1A2SIGMAR1ESR2HPGDMETAP1
SCHEMBL2532505 1.00 CYP1A2 (0.48) CYP1A2SIGMAR1ESR2HPGDMETAP1
SCHEMBL3340061 1.00 CYP1A2 (0.48) CYP1A2SIGMAR1ESR2HPGDMETAP1
Cyclohexane SCHEMBL12482977 1.00 CYP1A2 (0.48) CYP1A2SIGMAR1ESR2HPGDMETAP1
SCHEMBL16091690 1.00 CYP1A2 (0.48) CYP1A2SIGMAR1ESR2HPGDMETAP1
SCHEMBL2018398 1.00 CYP1A2 (0.48) CYP1A2SIGMAR1ESR2HPGDMETAP1
SCHEMBL21471 1.00
Ammonia Solution, Strong SCHEMBL4275522 0.97 CYP1A2 (0.46) CYP1A2SIGMAR1ESR2HPGDMETAP1
Water SCHEMBL10787450 0.97 CYP1A2 (0.46) CYP1A2SIGMAR1ESR2HPGDMETAP1
SCHEMBL80485 0.97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025035202-A1 IONIZABLE LIPIDS COMPRISING MACROCYCLIC RINGS FOR THE DELIVERY OF THERAPEUTIC AGENTS NANOVATION THERAPEUTICS INC. (CA) 2025-02-20 WO disclosed
US-20230365602-A1 COMPOUND FOR USE IN THE TREATMENT OF PROTOZOAL DISEASES AND PROCESS FOR PRODUCTION OF SAID COMPOUND QUADREL S.R.L. (IT) 2023-11-16 US disclosed
EP-4216960-A1 COMPOUND FOR USE IN THE TREATMENT OF PROTOZOAL DISEASES AND PROCESS FOR PRODUCTION OF SAID COMPOUND Quadrel S.r.l. (IT) 2023-08-02 EP disclosed
WO-2022063790-A1 COMPOUND FOR USE IN THE TREATMENT OF PROTOZOAL DISEASES AND PROCESS FOR PRODUCTION OF SAID COMPOUND QUADREL S.R.L. (IT) 2022-03-31 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-20230365602-A1 COMPOUND FOR USE IN THE TREATMENT OF PROTOZOAL DISEASES AND PROCESS FOR PRODUCTION OF SAID COMPOUND PIGO, PIGS, AGPS CYP1A2 1194/4885SIGMAR1 4672/4885ESR2 4355/4885

“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.