SCHEMBL20838

SCHEMBL20838

O=C1Nc2ccccc2/C1=C\c1ccco1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 4/20 1.00
ALDH1A1 P00352 3/20 0.68
MAPT P10636 2/20 0.68
GSK3B P49841 2/20 0.62
POLB P06746 2/20 0.61
HTT P42858 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
DYRK1A Q13627 1/20 0.61
MEN1 O00255 1/20 0.61
LMNA P02545 1/20 0.61
THRB P10828 1/20 0.61
ALOX12 P18054 1/20 0.61
KMT2A Q03164 1/20 0.61
TDP1 Q9NUW8 1/20 0.60
ITGA4 P13612 1/20 0.55
ITGB7 P26010 1/20 0.55
KDR P35968 1/20 0.54
SYK P43405 1/20 0.54
ATM Q13315 1/20 0.54
RET P07949 1/20 0.54

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
SCHEMBL20839 1.00 RPS6KA3 (1.00) RPS6KA3ALDH1A1MAPTGSK3BPOLB
SCHEMBL905690 1.00 RPS6KA3 (1.00) RPS6KA3ALDH1A1MAPTGSK3BPOLB
SCHEMBL31434409 0.85 RPS6KA3 (0.74) RPS6KA3ALDH1A1MAPTPOLBHTT
SCHEMBL1305323 0.82 POLB (0.80) RPS6KA3ALDH1A1GSK3BPOLBDYRK1A
SCHEMBL1305325 0.82 POLB (0.80) RPS6KA3ALDH1A1GSK3BPOLBDYRK1A
SCHEMBL5728158 0.81 RPS6KA3 (0.68) RPS6KA3ALDH1A1MAPTGSK3BPOLB
SCHEMBL18499299 0.81 RPS6KA3 (1.00) RPS6KA3ALDH1A1MAPTGSK3BTDP1
SCHEMBL6849771 0.81 RPS6KA3 (1.00) RPS6KA3ALDH1A1MAPTGSK3BMEN1
SCHEMBL14660146 0.81 RPS6KA3 (0.81) RPS6KA3ALDH1A1MAPTGSK3BPOLB
SCHEMBL29638294 0.81 RPS6KA3 (0.72) RPS6KA3ALDH1A1MAPTGSK3BPOLB

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-20190083495-A1 Methods Of Preventing Or Reducing A Fibrotic Response Using CSF1R Inhibitors MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2019-03-21 US disclosed
WO-2017176792-A1 METHODS OF PREVENTING OR REDUCING A FIBROTIC RESPONSE USING CSF 1R INHIBITORS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-10-12 WO disclosed
WO-2012025726-A1 Novel Hybrid Compounds UNIVERSITY OF GREENWICH (GB) 2012-03-01 WO disclosed
US-20100298376-A1 USE OF NOVEL NEUROPROTECTIVE 3-SUBSTITUTED INDOLONE COMPOSITIONS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-11-25 US disclosed
EP-2130829-A1 NOVEL HYDROXYINDOLE DERIVATIVE Theravalues Corporation (JP) 2009-12-09 EP 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 (2 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-20190083495-A1 Methods Of Preventing Or Reducing A Fibrotic Response Using CSF1R Inhibitors CSF1R, CSF3R, CD209 RPS6KA3 2786/4885ALDH1A1 1112/4885MAPT 3341/4885
US-20100298376-A1 USE OF NOVEL NEUROPROTECTIVE 3-SUBSTITUTED INDOLONE COMPOSITIONS NLN, HTT, PARK7 RPS6KA3 1532/4885ALDH1A1 2136/4885MAPT 59/4885

“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.