SCHEMBL17066435

SCHEMBL17066435

Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3c(C)cccc3F)[C@H]2c2ccc(NC3CCOCC3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
LMNA P02545 2/20 0.36
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
CCR5 P51681 5/20 0.34
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL12176131 0.93 POLB (0.40) POLBRAB9ANPC1LMNAMAPT
SCHEMBL13060153 0.92 GAA (0.40) RAB9ANPC1MAPTALDH1A1CNR1
SCHEMBL13060152 0.91 ALDH1A1 (0.43) RAB9ANPC1LMNAMAPTALDH1A1
SCHEMBL12176370 0.90 POLB (0.35) POLBRAB9ANPC1LMNAMAPT
SCHEMBL3628772 0.89 CCR5 (0.38) RAB9ALMNAMAPTALDH1A1CCR5
SCHEMBL3343277 0.89 CCR5 (0.38) RAB9ALMNAMAPTALDH1A1CCR5
SCHEMBL24016952 0.89 CNR2 (0.36) ALDH1A1CCR5CNR1CNR2
SCHEMBL13060014 0.89 CNR2 (0.36) ALDH1A1CCR5CNR1CNR2
SCHEMBL17805423 0.89 ALDH1A1 (0.37) RAB9ANPC1LMNAMAPTALDH1A1
SCHEMBL18532714 0.89 CNR2 (0.36) ALDH1A1CCR5CNR1CNR2

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 5 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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 POLB 3658/4885RAB9A 2420/4885NPC1 2134/4885
US-20160229802-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 POLB 3658/4885RAB9A 2420/4885NPC1 2134/4885
US-20230102258-A1 C5AR ANTAGONISTS C5AR1, C5AR2, C3AR1 POLB 3658/4885RAB9A 2420/4885NPC1 2134/4885

“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.