SCHEMBL15171237

SCHEMBL15171237

O=C(Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1)c1ccccc1Cl

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 10/20 0.72
TLR7 Q9NYK1 2/20 0.72
RXFP1 Q9HBX9 2/20 0.63
ALDH1A1 P00352 2/20 0.60
HTT P42858 2/20 0.60
TDP1 Q9NUW8 1/20 0.60
STK39 Q9UEW8 2/20 0.58
RORC P51449 1/20 0.56
PNLIP P16233 1/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
SMO Q99835 1/20 0.52

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
SCHEMBL15171235 0.91 TLR8 (0.76) TLR8TLR7RXFP1ALDH1A1HTT
SCHEMBL15171164 0.89 RORC (0.66) TLR8TLR7RXFP1ALDH1A1HTT
SCHEMBL15164887 0.85 TLR8 (0.65) TLR8TLR7RXFP1ALDH1A1HTT
SCHEMBL15164907 0.85 PNLIP (0.60) TLR8TLR7RXFP1ALDH1A1HTT
SCHEMBL3455896 0.82 RXFP1 (0.88) RXFP1ALDH1A1HTTMEN1LMNA
SCHEMBL15164892 0.82 MAPK1 (0.76) ALDH1A1HTTTDP1STK39PNLIP
SCHEMBL14384680 0.81 MTNR1A (0.66) TLR8TLR7HTTMEN1LMNA
SCHEMBL5369677 0.81 RORC (0.76) RXFP1TDP1RORCMEN1MAPT
SCHEMBL15164875 0.80 PNLIP (0.76) ALDH1A1HTTTDP1STK39PNLIP
SCHEMBL15171233 0.80 TLR8 (0.85) TLR8TLR7

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
EP-2563759-B1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC (US) 2022-04-06 EP disclosed
US-9353099-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2016-05-31 US disclosed
US-20150361075-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM AVENUE CAPITAL MANAGEMENT II, L.P. 2015-12-17 US disclosed
US-9090612-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2015-07-28 US disclosed
US-20140243366-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2014-08-28 US disclosed
US-8754219-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2014-06-17 US disclosed
US-20130203818-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2013-08-08 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-20140243366-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 TLR8 4453/4885TLR7 4757/4885RXFP1 2109/4885
US-20130203818-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 TLR8 4453/4885TLR7 4757/4885RXFP1 2109/4885
US-20150361075-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 TLR8 4453/4885TLR7 4757/4885RXFP1 2109/4885

“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.