SCHEMBL1851278

SCHEMBL1851278

c1ccc2c(Cc3c[nH]nn3)c[nH]c2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
CYP3A4 P08684 3/20 0.62
MAPT P10636 2/20 0.62
AHR P35869 2/20 0.62
TDP1 Q9NUW8 1/20 0.62
HTR6 P50406 2/20 0.50
ALDH1A1 P00352 3/20 0.47
HTR2A P28223 2/20 0.47
KDM4E B2RXH2 2/20 0.47
HTR1A P08908 1/20 0.47
HTT P42858 1/20 0.47
CYP2D6 P10635 2/20 0.47
MPO P05164 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2A6 P11509 1/20 0.47
NFKB1 P19838 1/20 0.47
HTR1D P28221 1/20 0.47
HTR1B P28222 1/20 0.47

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
Arundine SCHEMBL325162 0.78 MEN1 (1.00) GPR84MEN1KMT2ACYP3A4MAPT
SCHEMBL16431196 0.78 GPR84 (0.69) GPR84MEN1KMT2ACYP3A4MAPT
Arundine SCHEMBL28335217 0.77 MEN1 (0.95) GPR84MEN1KMT2ACYP3A4MAPT
SCHEMBL31744758 0.75 GPR84 (0.65) GPR84MEN1KMT2ACYP3A4MAPT
SCHEMBL735576 0.75 GPR84 (0.65) GPR84MEN1KMT2ACYP3A4MAPT
SCHEMBL2854051 0.75 HSPA5 (0.52) CYP2D6MPOCYP1A2TAAR1TSHR
SCHEMBL12559876 0.73 GPR84 (0.61) GPR84MEN1KMT2ACYP3A4MAPT
SCHEMBL9219681 0.73 GPR84 (0.61) GPR84MEN1KMT2ACYP3A4MAPT
SCHEMBL17179343 0.73 GPR84 (0.61) GPR84MEN1KMT2ACYP3A4MAPT
SCHEMBL469685 0.73 KDM4E (0.41) CYP3A4ALDH1A1KDM4ECYP1A2RAB9A

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242116-B2 Fused thiazole derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2012-08-14 US disclosed
US-8168634-B2 Thiazole derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2012-05-01 US disclosed
EP-2035436-B1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2011-05-25 EP disclosed
US-20100298310-A1 Thiazole Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-11-25 US disclosed
US-20100137302-A1 Fused Thiazole Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-06-03 US disclosed
WO-2009122148-A1 FUSED THIOPHENE AND THIAZOLE DERIVATIVES AS PI3K KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-10-08 WO disclosed
EP-2084155-A1 THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-08-05 EP disclosed
WO-2009071895-A1 FUSED THIAZOLE AND THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071890-A1 TRICYCLIC KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071888-A1 PYRROLOTHIAZOLES AS PI3-KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
EP-2035436-A1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-03-18 EP disclosed
WO-2008047109-A1 THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2008-04-24 WO disclosed
WO-2008001076-A1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2008-01-03 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 (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-20100137302-A1 Fused Thiazole Derivatives as Kinase Inhibitors PI4KA, PDPK1, PIK3CA GPR84 2236/4885MEN1 1461/4885KMT2A 2966/4885
US-20100298310-A1 Thiazole Derivatives as Kinase Inhibitors TEC, BTK, PI4KA GPR84 2281/4885MEN1 1425/4885KMT2A 1926/4885

“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.