SCHEMBL15088272

SCHEMBL15088272

Cc1cccc(C(=O)N2CCC[C@H](C(=O)Nc3cccc(C(C)(C)C)c3)[C@@H]2c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.48
▸ GAA P10253 2/20 0.48
▸ HSD11B1 P28845 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ HSD17B1 P14061 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ RHOA P61586 1/20 0.42
▸ KCNK3 O14649 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ PRMT5 O14744 2/20 0.40
▸ WDR77 Q9BQA1 2/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ APEX1 P27695 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
SCHEMBL18609269 0.89 ALDH1A1 (0.46) ALDH1A1GAAMAPK1NPSR1TSHR
SCHEMBL14959054 0.89 ALDH1A1 (0.46) ALDH1A1GAAMAPK1NPSR1TSHR
SCHEMBL18789915 0.89 ALDH1A1 (0.46) ALDH1A1GAAMAPK1NPSR1TSHR
SCHEMBL13059992 0.89 ALDH1A1 (0.46) ALDH1A1GAAMAPK1NPSR1TSHR
SCHEMBL12176383 0.88 ALDH1A1 (0.44) ALDH1A1GAAMAPK1NPSR1TSHR
SCHEMBL24016857 0.87 HSD17B10 (0.46) ALDH1A1GAANPSR1TSHRRXFP1
SCHEMBL18532606 0.87 ALDH1A1 (0.43) ALDH1A1GAANPSR1TSHRRXFP1
SCHEMBL12176191 0.87 ALDH1A1 (0.43) ALDH1A1GAANPSR1TSHRRXFP1
SCHEMBL18609695 0.87 HSD17B10 (0.46) ALDH1A1GAANPSR1TSHRRXFP1
SCHEMBL14959019 0.87 HSD17B10 (0.46) ALDH1A1GAANPSR1TSHRRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230102258-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2023-03-30 — — US disclosed
US-20170114017-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2017-04-27 — — US disclosed
US-9573897-B2 C5AR antagonists CHEMOCENTRYX, INC. (US) 2017-02-21 — — US disclosed
US-20160229802-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2016-08-11 — — US disclosed
US-9126939-B2 C5AR antagonists CHEMOCENTRYX, INC. 2015-09-08 — — US disclosed
US-20130172347-A1 C5AR ANTAGONISTS CHEMOCENTRYX, INC. 2013-07-04 — — 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 (4 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-20170114017-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 ALDH1A1 2966/4885GAA 4630/4885HSD11B1 4685/4885
US-20160229802-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 ALDH1A1 2966/4885GAA 4630/4885HSD11B1 4685/4885
US-20230102258-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 ALDH1A1 2966/4885GAA 4630/4885HSD11B1 4685/4885
US-20130172347-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 ALDH1A1 2966/4885GAA 4630/4885HSD11B1 4685/4885

“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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