SCHEMBL13184313

SCHEMBL13184313

CCc1ccc(Cl)c2[nH]ccc12

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ CCR8 P51685 1/20 0.38
▸ KMT2A Q03164 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ P2RX7 Q99572 4/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ SIRT2 Q8IXJ6 1/20 0.36
▸ RIPK1 Q13546 3/20 0.35
▸ RHEB Q15382 1/20 0.33
▸ CTRC Q99895 1/20 0.33
▸ AXL P30530 1/20 0.32
▸ PRKCI P41743 1/20 0.32

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
SCHEMBL15826676 0.85 ALDH1A1 (0.38) AHRCCR8KMT2AP2RX7SIRT2
SCHEMBL12748351 0.81 HTR2A (0.41) AHRHTR2ACCR8KMT2ASLC6A4
SCHEMBL20756906 0.78 HTR2A (0.39) HTR2ACCR8KMT2AP2RX7CREBBP
SCHEMBL2599781 0.77 AHR (0.48) AHRHTR2ACCR8KMT2ASIRT2
SCHEMBL25846725 0.74 ACE2 (0.33) CCR8KMT2AP2RX7
SCHEMBL15826672 0.74 P2RX7 (0.39) AHRCCR8KMT2AP2RX7SIRT2
SCHEMBL1465882 0.74 AHR (0.42) AHRCCR8KMT2AP2RX7CREBBP
Acetic Acid SCHEMBL27953393 0.73 CREBBP (0.41) AHRCCR8KMT2AP2RX7CREBBP
SCHEMBL15799363 0.73 P2RX7 (0.36) AHRCCR8KMT2AP2RX7SIRT2
SCHEMBL21725760 0.73 ACHE (0.35) HTR2AP2RX7

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-8324216-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2012-12-04 — — US disclosed
US-20100240618-A1 SUBSTITUTED PIPERAZINES CHEMOCENTRYX, INC. (US) 2010-09-23 — — US disclosed
US-7589199-B2 Substituted piperazines CHEMOCENTRYX, INC. (US) 2009-09-15 — — US disclosed
US-7435831-B2 Bicyclic and bridged nitrogen heterocycles CHEMOCENTRYX, INC. (US) 2008-10-14 — — US disclosed
US-7435830-B2 Bicyclic and bridged nitrogen heterocycles CHEMOCENTRYX, INC. (US) 2008-10-14 — — 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 (1 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-20100240618-A1 SUBSTITUTED PIPERAZINES CCR1, CCR3, CCRL2 AHR 84/4885HTR2A 588/4885CCR8 9/4885

“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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