SCHEMBL22340469

SCHEMBL22340469

Cn1cc(N2CCC(Cc3ccccc3)CC2)cn1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
SLC6A2 P23975 4/20 0.53
SLC6A4 P31645 4/20 0.53
PRMT6 Q96LA8 3/20 0.50
TSHR P16473 2/20 0.50
CCR3 P51677 2/20 0.50
LMNA P02545 2/20 0.50
MAPT P10636 2/20 0.50
ALDH1A1 P00352 1/20 0.50
HTT P42858 1/20 0.50
CARM1 Q86X55 2/20 0.49
PRMT3 O60678 1/20 0.49
PRMT1 Q99873 1/20 0.49
PRMT8 Q9NR22 1/20 0.49
KCNH2 Q12809 1/20 0.48
PKM P14618 1/20 0.47

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
SCHEMBL7241082 0.80 SLC6A2 (0.71) SMN1; SMN2SLC6A2SLC6A4PRMT6TSHR
SCHEMBL19135757 0.77 SLC6A2 (0.53) SMN1; SMN2SLC6A2SLC6A4PRMT6TSHR
SCHEMBL327856 0.74 CCR3 (0.66) PRMT6CCR3CARM1PRMT3PRMT1
SCHEMBL22324836 0.74 SMN1; SMN2 (0.50) SMN1; SMN2SLC6A2SLC6A4PRMT6TSHR
SCHEMBL3540368 0.73 SLC6A2 (0.63) SMN1; SMN2SLC6A2SLC6A4PRMT6TSHR
SCHEMBL3436965 0.73 PRMT6 (0.62) SLC6A2SLC6A4PRMT6CCR3CARM1
SCHEMBL941899 0.73 SLC6A2 (0.79) SMN1; SMN2SLC6A2SLC6A4PRMT6TSHR
SCHEMBL6427944 0.73 MEN1 (0.61) SMN1; SMN2SLC6A2SLC6A4PRMT6TSHR
SCHEMBL7850831 0.72 HRH3 (0.57) SLC6A2SLC6A4PRMT6TSHRCCR3
SCHEMBL2952169 0.72 MEN1 (0.65) SLC6A2SLC6A4MAPTALDH1A1

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-20220144797-A1 20-HETE FORMATION INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2022-05-12 US disclosed
WO-2020163689-A1 20-HETE FORMATION INHIBITORS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-08-13 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-20220144797-A1 20-HETE FORMATION INHIBITORS CYP4A22, ALOX5, ALOX15 SMN1; SMN2 2585/4885SLC6A2 1927/4885SLC6A4 452/4885

“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.