SCHEMBL6982863

SCHEMBL6982863

Cc1cc(C(Oc2ccccc2)(C(=O)O)C(F)(F)F)ccc1NC(=O)NC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.45
▸ HTT P42858 3/20 0.45
▸ ABCC9 O60706 2/20 0.40
▸ ABCC8 Q09428 2/20 0.40
▸ KCNJ11 Q14654 2/20 0.40
▸ KCNJ8 Q15842 2/20 0.40
▸ RAF1 P04049 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ LMNA P02545 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ PDK1 Q15118 1/20 0.36
▸ PDK2 Q15119 1/20 0.36
▸ PDK3 Q15120 1/20 0.36
▸ PDK4 Q16654 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ DHODH Q02127 1/20 0.36
▸ IDH1 O75874 1/20 0.36

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
SCHEMBL6977143 0.86 MAPT (0.41) MAPTHTTABCC9ABCC8KCNJ11
SCHEMBL6981268 0.84 RAF1 (0.43) MAPTHTTRAF1RAB9AMEN1
SCHEMBL11575689 0.72 CYP1A2 (0.39) PPARAPDK1PDK2PDK3PDK4
SCHEMBL6975862 0.71 RAF1 (0.42) RAF1RAB9AMEN1KMT2ALMNA
SCHEMBL12782339 0.69 RAB9A (0.60) MAPTHTTRAB9AMEN1KMT2A
SCHEMBL11749750 0.67 RAB9A (0.60) RAF1RAB9AMEN1KMT2AGAA
SCHEMBL11751476 0.66 KMT2A (0.50) MAPTHTTRAB9AMEN1KMT2A
SCHEMBL11255956 0.65 MEN1 (0.42) MAPTHTTRAB9AMEN1KMT2A
SCHEMBL6984071 0.65 PPARG (0.45) MAPTHTTRAF1MEN1KMT2A
SCHEMBL25494271 0.65 MEN1 (0.45) MAPTHTTRAB9AMEN1KMT2A

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-1030835-B1 UREA DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS ASTRAZENECA UK LTD (GB) 2003-01-22 — — EP disclosed
US-6344570-B1 ANTISTICKING AGENTS FOR CELLS ASTRAZENECA UK LIMITED (GB) 2002-02-05 — — US disclosed
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