SCHEMBL15366366

SCHEMBL15366366

ClCCN1C[C@@H]2C[C@H]1CN2Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.47
MAPT P10636 1/20 0.44

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
SCHEMBL5858231 0.85 SIGMAR1 (0.49) SIGMAR1MAPT
SCHEMBL5496544 0.85 SIGMAR1 (0.46) SIGMAR1MAPT
SCHEMBL11776188 0.83 SIGMAR1 (0.50) SIGMAR1MAPT
SCHEMBL6995832 0.83 SIGMAR1 (0.50) SIGMAR1MAPT
SCHEMBL8698904 0.83 SIGMAR1 (0.50) SIGMAR1MAPT
SCHEMBL5493933 0.81 SIGMAR1 (0.43) SIGMAR1MAPT
SCHEMBL20328234 0.81 SIGMAR1 (0.51) SIGMAR1MAPT
SCHEMBL10211436 0.81 SIGMAR1 (0.48) SIGMAR1MAPT
Hydrochloric Acid SCHEMBL11778162 0.80 SIGMAR1 (0.48) SIGMAR1MAPT
Hydrochloric Acid SCHEMBL11778155 0.80 SIGMAR1 (0.48) SIGMAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2847208-B1 C-17 BICYCLIC AMINES OF TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO 5) LTD (GB) 2017-10-04 EP disclosed
EP-2847208-B1 C-17 BICYCLIC AMINES OF TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO 5) LTD (GB) 2017-10-04 EP disclosed
US-8889854-B2 C-17 bicyclic amines of triterpenoids with HIV maturation inhibitory activity BRISTOL-MYERS SQUIBB COMPANY (US) 2014-11-18 US disclosed
US-8889854-B2 C-17 bicyclic amines of triterpenoids with HIV maturation inhibitory activity BRISTOL-MYERS SQUIBB COMPANY (US) 2014-11-18 US disclosed
US-8889854-B2 C-17 bicyclic amines of triterpenoids with HIV maturation inhibitory activity BRISTOL-MYERS SQUIBB COMPANY (US) 2014-11-18 US disclosed
US-20130296554-A1 C-17 BICYCLIC AMINES OF TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2013-11-07 US disclosed
US-20130296554-A1 C-17 BICYCLIC AMINES OF TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2013-11-07 US disclosed
US-20130296554-A1 C-17 BICYCLIC AMINES OF TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2013-11-07 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-20130296554-A1 C-17 BICYCLIC AMINES OF TRITERPENOIDS WITH HIV MATURATION INHIBITORY ACTIVITY CYP51A1, CDK17, UGT2B17 SIGMAR1 1469/4885MAPT 2076/4885

“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.