SCHEMBL9337325

SCHEMBL9337325

C=C(c1ccc(OC)c(CO)c1)c1nc2cc(F)ccc2s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 1/20 0.46
▸ PTGDR2 Q9Y5Y4 8/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ TUBB4A P04350 1/20 0.38
▸ TUBB P07437 1/20 0.38
▸ TUBA3C P0DPH7 1/20 0.38
▸ TUBA1B P68363 1/20 0.38
▸ TUBA4A P68366 1/20 0.38
▸ TUBB4B P68371 1/20 0.38
▸ TUBB3 Q13509 1/20 0.38
▸ TUBB2A Q13885 1/20 0.38
▸ TUBB8 Q3ZCM7 1/20 0.38
▸ TUBA3E Q6PEY2 1/20 0.38
▸ TUBA1A Q71U36 1/20 0.38
▸ TUBA1C Q9BQE3 1/20 0.38
▸ TUBB6 Q9BUF5 1/20 0.38
▸ TUBB2B Q9BVA1 1/20 0.38
▸ TUBB1 Q9H4B7 1/20 0.38
▸ CSNK1D P48730 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.37

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
SCHEMBL9339138 0.81 AHR (0.45) AHRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL9387728 0.79 HSD17B10 (0.43) AHRLMNAHDAC6DYRK1AMAOB
SCHEMBL9338940 0.76 MAPT (0.42) LMNAHDAC6DYRK1AGAAMAOB
SCHEMBL9335011 0.76 AKR1B1 (0.40) AHRLMNAPOLBDYRK1AMAOB
SCHEMBL9337335 0.74 KAT8 (0.51) AHRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL9337315 0.74 KAT8 (0.51) AHRTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL9389077 0.73 MAPT (0.48) ALDH1A1KDM4ELMNADYRK1AHCRTR1
SCHEMBL2908313 0.72 PDE4A (0.50) ALDH1A1KDM4EPOLBPKMGAA
SCHEMBL9339063 0.72 CYSLTR1 (0.36) DYRK1AHCRTR1
SCHEMBL9388756 0.71 HSD17B10 (0.38) AHRCYP3A4HDAC6CYP2C9DYRK1A

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
EP-0533695-B1 IMIDAZO (4,5-c) PYRIDINES WITH PAF ANTAGONIST ACTIVITY PFIZER (US) 1994-10-05 — — EP disclosed
US-5322847-A Inhibit platelet activating factor, block leukotriene D4 receptors PFIZER INC. (US) 1994-06-21 — — US disclosed
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