SCHEMBL15344948

SCHEMBL15344948

CCN1CCN(c2nccc(C)n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SORD Q00796 2/20 0.52
▸ SLC6A7 Q99884 1/20 0.48
▸ OGA O60502 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ ACHE P22303 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ CHRNA7 P36544 1/20 0.43
▸ POLB P06746 1/20 0.43

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
SCHEMBL13033969 0.83 ACHE (0.56) SORDSLC6A7OGAKDM4EALDH1A1
SCHEMBL17547159 0.82 ACHE (0.43) KDM4EACHEKMT2ALMNACHRNA7
SCHEMBL9488628 0.81 SORD (0.56) SORDSLC6A7OGAACHE
SCHEMBL7904079 0.80 SORD (0.55) SORDSLC6A7OGAKDM4EALDH1A1
SCHEMBL13806030 0.80 SORD (0.55) SORDSLC6A7OGAKDM4EALDH1A1
SCHEMBL18228454 0.80 SORD (0.55) SORDSLC6A7OGAKDM4EALDH1A1
SCHEMBL15344921 0.80 SORD (0.52) SORDSLC6A7OGAKDM4EALDH1A1
SCHEMBL15341949 0.80 SORD (0.45) SORDKDM4EACHECHRNA7
Hydrochloric Acid SCHEMBL10410805 0.79 SORD (0.55) SORDSLC6A7OGAACHE
SCHEMBL7489291 0.79 SORD (0.49) SORDSLC6A7ACHE

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
EP-3070081-B1 BENZOTHIAZOL-6-YL ACETIC ACID DERIVATIVES AND THEIR USE FOR TREATING AN HIV INFECTION GILEAD SCIENCES INC (US) 2018-02-28 — — EP disclosed
US-20160015690-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2016-01-21 — — US disclosed
US-8987250-B2 Therapeutic compounds GILEAD SCIENCES, INC. (US) 2015-03-24 — — US disclosed
US-20130281433-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2013-10-24 — — 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 (2 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-20160015690-A1 THERAPEUTIC COMPOUNDS NQO1, HAVCR2, CCR5 SORD 265/4885SLC6A7 2185/4885OGA 1700/4885
US-20130281433-A1 THERAPEUTIC COMPOUNDS NQO1, HAVCR2, CCR5 SORD 265/4885SLC6A7 2185/4885OGA 1700/4885

“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.

Send feedback