SCHEMBL13060070

SCHEMBL13060070

Cc1c(F)cccc1C(=O)N1CCC[C@H](C(=O)Nc2cccc(C(C)(C)C)c2)[C@@H]1c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ PRMT5 O14744 2/20 0.39
▸ WDR77 Q9BQA1 2/20 0.39
▸ ACKR3 P25106 1/20 0.38
▸ PREP P48147 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ UBE2M P61081 3/20 0.37
▸ DCUN1D1 Q96GG9 3/20 0.37
▸ TACR1 P25103 2/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36

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
SCHEMBL15088271 0.91 RXFP1 (0.44) RXFP1HSD17B10ALDH1A1NPSR1PRMT5
SCHEMBL12176580 0.91 RXFP1 (0.45) RXFP1HSD17B10ALDH1A1PRMT5WDR77
SCHEMBL24016857 0.90 HSD17B10 (0.46) RXFP1HSD17B10ALDH1A1NPSR1PRMT5
SCHEMBL18609695 0.90 HSD17B10 (0.46) RXFP1HSD17B10ALDH1A1NPSR1PRMT5
SCHEMBL14959019 0.90 HSD17B10 (0.46) RXFP1HSD17B10ALDH1A1NPSR1PRMT5
SCHEMBL12176578 0.89 ALDH1A1 (0.44) RXFP1HSD17B10ALDH1A1NPSR1TDP1
SCHEMBL12176054 0.88 RXFP1 (0.41) RXFP1ALDH1A1NPSR1TDP1PRMT5
SCHEMBL18790219 0.88 HSD17B10 (0.41) RXFP1HSD17B10ALDH1A1NPSR1TDP1
SCHEMBL12176050 0.88 HSD17B10 (0.44) RXFP1HSD17B10ALDH1A1NPSR1TDP1
SCHEMBL12176097 0.88 PREP (0.43) RXFP1HSD17B10ALDH1A1NPSR1TDP1

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 7 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
US-20100311753-A1 C5aR ANTAGONISTS CHEMOCENTRYX, INC. (US) 2010-12-09 — — 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 (5 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 RXFP1 911/4885HSD17B10 4597/4885ALDH1A1 2966/4885
US-20160229802-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 RXFP1 911/4885HSD17B10 4597/4885ALDH1A1 2966/4885
US-20230102258-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 RXFP1 911/4885HSD17B10 4597/4885ALDH1A1 2966/4885
US-20100311753-A1 C5aR ANTAGONISTS C5AR1, C5AR2, C3AR1 RXFP1 911/4885HSD17B10 4597/4885ALDH1A1 2966/4885
US-20130172347-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 RXFP1 911/4885HSD17B10 4597/4885ALDH1A1 2966/4885

“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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