SCHEMBL26499306

SCHEMBL26499306

O=c1n(-c2ccc(Cl)cc2)cnn1CCN1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.51
DRD3 P35462 4/20 0.51
MCHR1 Q99705 8/20 0.50
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
KCNH2 Q12809 3/20 0.44
SIGMAR1 Q99720 2/20 0.44
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
MCHR2 Q969V1 1/20 0.40

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
SCHEMBL22349797 0.75 PPARD (0.48) HTTKDM4EALDH1A1PPARGPPARD
SCHEMBL11972931 0.73 ALDH1A1 (0.41) DRD2DRD3MCHR1KCNH2TDP1
SCHEMBL31548630 0.73 HTR1A (0.45) MCHR1KCNH2SIGMAR1TDP1ALDH1A1
SCHEMBL31548631 0.73 HTR1A (0.45) MCHR1KCNH2SIGMAR1TDP1ALDH1A1
SCHEMBL22349810 0.70 MAPT (0.64) HTTATMTDP1ALDH1A1PPARG
SCHEMBL9243893 0.69 PPARD (0.42) HTTATMALDH1A1PPARGPPARD
SCHEMBL16196854 0.69 MCHR1 (0.37) MCHR1CYP3A4CYP2C19SIGMAR1MCHR2
SCHEMBL7386189 0.68 DGAT1 (0.40) MCHR1KCNH2SIGMAR1PPARGPPARD
SCHEMBL10144435 0.67 MCHR1 (1.00) MCHR1CYP3A4CYP2C19KCNH2
SCHEMBL14180786 0.65 CNR1 (0.50) DRD2DRD3MCHR1CYP3A4CYP2C19

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-20230321082-A1 USE OF TRIAZOLE ANALOGUES FOR INHIBITION OF A TRIPARTITE VOR PROTEIN COMPLEX IN MULTICELLULAR ORGANISMS BOE TECHNOLOGY GROUP CO., LTD. (CN) 2023-10-12 US disclosed
US-20230321082-A1 USE OF TRIAZOLE ANALOGUES FOR INHIBITION OF A TRIPARTITE VOR PROTEIN COMPLEX IN MULTICELLULAR ORGANISMS BOE TECHNOLOGY GROUP CO., LTD. (CN) 2023-10-12 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 (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-20230321082-A1 USE OF TRIAZOLE ANALOGUES FOR INHIBITION OF A TRIPARTITE VOR PROTEIN COMPLEX IN MULTICELLULAR ORGANISMS RABL3, VAPA, VAPB DRD2 3895/4885DRD3 1756/4885MCHR1 1967/4885

“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.