SCHEMBL9196255

SCHEMBL9196255

FC(F)(F)Oc1cc(OC(F)(F)F)nc(Cl)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.34
CHRNA7 P36544 8/20 0.33
ALDH1A1 P00352 2/20 0.32
ALOX15 P16050 2/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
TUBB4A P04350 1/20 0.30
TUBB P07437 1/20 0.30
TUBA3C P0DPH7 1/20 0.30
TUBA1B P68363 1/20 0.30
TUBA4A P68366 1/20 0.30
TUBB4B P68371 1/20 0.30
TUBB3 Q13509 1/20 0.30
TUBB2A Q13885 1/20 0.30
TUBB8 Q3ZCM7 1/20 0.30
TUBA3E Q6PEY2 1/20 0.30
TUBA1A Q71U36 1/20 0.30
TUBA1C Q9BQE3 1/20 0.30
TUBB6 Q9BUF5 1/20 0.30
TUBB2B Q9BVA1 1/20 0.30

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
SCHEMBL7807011 0.89 ATF1 (0.34) PGK1CHRNA7NFKB1
SCHEMBL9196183 0.86 KDM4E (0.35) PGK1CHRNA7ALDH1A1HTTLMNA
SCHEMBL9192072 0.84 ALDH1A1 (0.31) ALDH1A1ALOX15TSHRHTT
SCHEMBL9188793 0.78 ALDH1A1 (0.33) ALDH1A1ALOX15TSHRHTT
SCHEMBL7933970 0.76 HSP90AA1 (0.38) CHRNA7ALDH1A1ALOX15NPC1GMNN
SCHEMBL9194620 0.74 ATF1 (0.36) NFKB1
SCHEMBL9586268 0.74 IGF1R (0.32) PGK1ALDH1A1SMN1; SMN2
SCHEMBL20660485 0.73
SCHEMBL7932080 0.73 CHRNA7 (0.38) PGK1CHRNA7ALDH1A1LMNACYP1A2
SCHEMBL7808650 0.73 KMT2A (0.50) ALDH1A1CYP1A2RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0445644-B1 Trifluoro- respectively chlorodifluoromethoxy pyrimidines and process for their preparation BASF AG (DE) 1995-05-24 EP disclosed
US-5237063-A TRIFLUORO- AND CHLORODIFLUOROMETHOXYPYRIMIDINES AND THE PREPARATION THEREOF BASF AKTIENGESELLSCHAFT (DE) 1993-08-17 US disclosed
EP-0445644-A1 Trifluoro- respectively chlorodifluoromethoxy pyrimidines and process for their preparation BASF Aktiengesellschaft (DE) 1991-09-11 EP disclosed