SCHEMBL12480470

SCHEMBL12480470

O=Cc1ccnc(C(F)(F)F)c1F

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.42
CCR5 P51681 1/20 0.42
CCR8 P51685 1/20 0.42
HTT P42858 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TRIM24 O15164 1/20 0.33
TRIM33 Q9UPN9 1/20 0.33
LMNA P02545 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ERN1 O75460 1/20 0.31
TSHR P16473 1/20 0.30
MEN1 O00255 1/20 0.30
THRB P10828 1/20 0.30
BLM P54132 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL26880654 0.81 CCR1 (0.42) CCR1CCR5CCR8HTTHSD17B10
SCHEMBL30390711 0.81 CCR1 (0.42) CCR1CCR5CCR8HTTHSD17B10
SCHEMBL29954308 0.79 CCR1 (0.41) CCR1CCR5CCR8HTTHSD17B10
SCHEMBL28052033 0.79 CCR1 (0.41) CCR1CCR5CCR8HTTHSD17B10
SCHEMBL12479704 0.77 HTT (0.33) HTTHSD17B10LMNASMN1; SMN2
SCHEMBL12479706 0.77 HTT (0.33) HTTHSD17B10LMNASMN1; SMN2
SCHEMBL28114355 0.75 CCR1 (0.48) CCR1CCR5CCR8TRIM24TRIM33
SCHEMBL29955416 0.75 CCR1 (0.48) CCR1CCR5CCR8TRIM24TRIM33
SCHEMBL2514186 0.74 TRIM24 (0.52) CCR1CCR5CCR8HTTHSD17B10
SCHEMBL30524918 0.74 TRIM24 (0.52) CCR1CCR5CCR8HTTHSD17B10

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110003200-A P2X7 regulator 詹森药业有限公司 2019-07-12 CN claimed
CN-105209464-B P2X7 modulators 詹森药业有限公司 2019-01-01 CN claimed
EP-2970267-B3 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-30 EP claimed
CN-110003200-B P2X7 modulators 詹森药业有限公司 2021-11-26 CN disclosed
EP-3746429-A1 PROCESSES FOR PREPARING (1 -(3-FLUORO-2-(TRIFLUOROMETHYL)ISONICOTINYL)PIPERIDINE-4-ONE) Incyte Corporation (US) 2020-12-09 EP disclosed
WO-2019152374-A1 PROCESSES FOR PREPARING (1 -(3-FLUORO-2-(TRIFLUOROMETHYL)ISONICOTINYL)PIPERIDINE-4-ONE) INCYTE CORPORATION (US) 2019-08-08 WO disclosed
CN-110003200-A P2X7 regulator 詹森药业有限公司 2019-07-12 CN disclosed
EP-3495365-A1 P2X7 MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-12 EP disclosed
CN-105209464-B P2X7 modulators 詹森药业有限公司 2019-01-01 CN disclosed
EP-3239151-B1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-11-07 EP disclosed
EP-3239151-A1 P2X7 MODULATORS Janssen Pharmaceutica NV (BE) 2017-11-01 EP disclosed
US-9085555-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2015-07-21 US disclosed
US-9085555-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2015-07-21 US disclosed
WO-2014152604-A1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2014-09-25 WO disclosed
CN-103402996-A Indole compounds or analogues thereof useful for the treatment of age-related macular degeneration (AMD) NOVARTIS AG 2013-11-20 CN disclosed
EP-2661433-A1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) Novartis AG (CH) 2013-11-13 EP disclosed
US-20120295884-A1 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2012-11-22 US disclosed
US-20120295884-A1 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2012-11-22 US disclosed
US-20120295884-A1 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2012-11-22 US disclosed
WO-2012093101-A1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) NOVARTIS AG (CH) 2012-07-12 WO 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-20120295884-A1 Complement pathway modulators and uses thereof C5, C3AR1, C9 CCR1 658/4885CCR5 470/4885CCR8 1165/4885

“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.