SCHEMBL4802899

SCHEMBL4802899

COc1cc(-c2nc3cc(F)ccc3s2)cc(OC)c1OC

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.76
F2RL3 Q96RI0 1/20 0.50
APP P05067 1/20 0.49
TUBB4A P04350 2/20 0.48
TUBB P07437 2/20 0.48
TUBA3C P0DPH7 2/20 0.48
TUBA1B P68363 2/20 0.48
TUBA4A P68366 2/20 0.48
TUBB4B P68371 2/20 0.48
TUBB3 Q13509 2/20 0.48
TUBB2A Q13885 2/20 0.48
TUBB8 Q3ZCM7 2/20 0.48
TUBA3E Q6PEY2 2/20 0.48
TUBA1A Q71U36 2/20 0.48
TUBA1C Q9BQE3 2/20 0.48
TUBB6 Q9BUF5 2/20 0.48
TUBB2B Q9BVA1 2/20 0.48
TUBB1 Q9H4B7 2/20 0.48
KDM4E B2RXH2 4/20 0.47
SMN1; SMN2 Q16637 4/20 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
SCHEMBL4797786 0.86 AHR (1.00) AHRF2RL3APPKDM4ESMN1; SMN2
SCHEMBL30307425 0.86 AHR (1.00) AHRF2RL3APPKDM4ESMN1; SMN2
SCHEMBL30288215 0.86 AHR (1.00) AHRF2RL3APPKDM4ESMN1; SMN2
SCHEMBL25877004 0.85 AHR (0.70) AHRF2RL3APPKDM4ESMN1; SMN2
SCHEMBL12471024 0.83 AHR (0.53) AHRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL24140755 0.83 AHR (0.67) AHRF2RL3APPKDM4ESMN1; SMN2
SCHEMBL25876975 0.83 AHR (0.67) AHRF2RL3APPKDM4ESMN1; SMN2
SCHEMBL4806255 0.83 SMN1; SMN2 (0.67) AHRF2RL3APPKDM4ESMN1; SMN2
SCHEMBL12471049 0.83 AHR (0.53) AHRKDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL4803129 0.83 AHR (0.79) AHRF2RL3APPKDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7384966-B2 2-arylbenzothiazole derivatives PHARMINXO LIMITED (GB) 2008-06-10 US disclosed
US-20060063816-A1 2-Arylbenzothiazole derivatives STEVENS MALCOLM F G 2006-03-23 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 (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-20060063816-A1 2-Arylbenzothiazole derivatives CX3CR1, HCN2, CYBB AHR 60/4885F2RL3 3432/4885APP 1876/4885

“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.