SCHEMBL15345159

SCHEMBL15345159

Cc1ccnc(N2CCC(C)(O)CC2)n1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SORD Q00796 1/20 0.52
▸ SLC6A7 Q99884 1/20 0.48
▸ KDM4E B2RXH2 11/20 0.47
▸ ALDH1A1 P00352 7/20 0.47
▸ HSD17B10 Q99714 4/20 0.47
▸ HPGD P15428 3/20 0.47
▸ POLB P06746 1/20 0.43
▸ OGA O60502 1/20 0.42
▸ MAPK1 P28482 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL26646178 0.83 SORD (0.52) SORDSLC6A7KDM4EALDH1A1HSD17B10
SCHEMBL15740938 0.82 OGA (0.43) OGAKMT2A
SCHEMBL13806030 0.80 SORD (0.55) SORDSLC6A7KDM4EALDH1A1HSD17B10
SCHEMBL7904079 0.80 SORD (0.55) SORDSLC6A7KDM4EALDH1A1HSD17B10
SCHEMBL18228454 0.80 SORD (0.55) SORDSLC6A7KDM4EALDH1A1HSD17B10
SCHEMBL22616932 0.80 KDM4E (0.49) SORDSLC6A7KDM4EALDH1A1HSD17B10
SCHEMBL20745663 0.80 SORD (0.41) SORDKMT2A
SCHEMBL15341839 0.80 SORD (0.45) SORDKMT2A
SCHEMBL12597157 0.79 KDM4E (0.55) SORDSLC6A7KDM4EALDH1A1HSD17B10
SCHEMBL30556651 0.79 SORD (0.45) SORDSLC6A7KDM4EALDH1A1HSD17B10

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 2185/4885KDM4E 4221/4885
US-20130281433-A1 THERAPEUTIC COMPOUNDS NQO1, HAVCR2, CCR5 SORD 265/4885SLC6A7 2185/4885KDM4E 4221/4885

“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.

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