SCHEMBL944734

SCHEMBL944734

Cn1cc(C[C@H]2COCCN2)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.48
SLC6A4 P31645 1/20 0.46
HTR2A P28223 1/20 0.43
HTR6 P50406 9/20 0.41
LMNA P02545 3/20 0.41
OPRM1 P35372 2/20 0.40
OPRK1 P41145 2/20 0.40
OGFRL1 Q5TC84 2/20 0.40
OPRD1 P41143 1/20 0.40
OPRL1 P41146 1/20 0.40
GLA P06280 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
AHR P35869 1/20 0.39

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
SCHEMBL3433438 0.85 CNR2 (0.45) SLC6A4LMNAOPRM1OPRK1OGFRL1
SCHEMBL3433442 0.85 CNR2 (0.45) SLC6A4LMNAOPRM1OPRK1OGFRL1
SCHEMBL947139 0.81 SLC6A4 (0.45) SLC6A4OPRM1OPRK1OGFRL1OPRD1
SCHEMBL945731 0.77 CNR2 (0.40) ALDH1A1
SCHEMBL3433332 0.77 CNR2 (0.40) ALDH1A1
SCHEMBL3434033 0.75 HTR1A (0.37) ALDH1A1
SCHEMBL1177022 0.74 CYP2D6 (0.56) HTR6LMNAOPRM1ALDH1A1
SCHEMBL28780669 0.72 SLC6A4 (0.75) GPR84SLC6A4HTR2ALMNAGLA
SCHEMBL1176924 0.72 HTR6 (0.64) GPR84SLC6A4HTR2AHTR6AHR
SCHEMBL1177387 0.72 HTR6 (0.64) GPR84SLC6A4HTR2AHTR6AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8710054-B2 Fused thiazole derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2014-04-29 US disclosed
EP-2170906-B1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2013-04-03 EP disclosed
US-20130079330-A1 Fused Thiazole Derivatives as Kinase Inhibitors UCB PHARMA, S.A. (BE) 2013-03-28 US disclosed
US-8338592-B2 Fused thiazole derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2012-12-25 US disclosed
EP-2035436-B1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2011-05-25 EP disclosed
US-20110003785-A1 Fused Thiazole Derivatives As Kinase Inhibitors UCB PHARMA, S.A. (BE) 2011-01-06 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 (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-20110003785-A1 Fused Thiazole Derivatives As Kinase Inhibitors PI4KA, PDPK1, MAP4K2 GPR84 2634/4885SLC6A4 2949/4885HTR2A 2420/4885
US-20130079330-A1 Fused Thiazole Derivatives as Kinase Inhibitors PI4KA, PDPK1, MAP4K2 GPR84 2634/4885SLC6A4 2949/4885HTR2A 2420/4885

“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.