SCHEMBL16433245

SCHEMBL16433245

COc1cc(-c2c[nH]cn2)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.47
▸ PHF8 Q9UPP1 1/20 0.43
▸ PDGFRB P09619 7/20 0.41
▸ PAX8 Q06710 1/20 0.41
▸ KIT P10721 3/20 0.39
▸ KDR P35968 3/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ GRK6 P43250 1/20 0.38
▸ PDGFRA P16234 1/20 0.38
▸ PIK3CD O00329 1/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ EGFR P00533 1/20 0.38
▸ HCK P08631 1/20 0.38
▸ SRC P12931 1/20 0.38
▸ PIK3CA P42336 1/20 0.38

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
SCHEMBL16432554 0.88 ALDH1A1 (0.51) PDGFRBKITMEN1NPC1ALDH1A1
SCHEMBL16416060 0.79 MAPT (0.49) PDGFRBKITMEN1NPC1ALDH1A1
SCHEMBL18042052 0.79 DAPK3 (0.46) KDRMEN1NPC1RAB9AKMT2A
SCHEMBL29021937 0.77 PDGFRB (0.47) PDGFRBKITKDRALDH1A1
SCHEMBL2063725 0.76 KMO (0.47) ABL1PIK3CAEPHB4
SCHEMBL19311962 0.75 ALDH1A1 (0.46) ALDH1A1MTOR
SCHEMBL12096274 0.74 KDM1A (0.46) KDM1APHF8PDGFRBPAX8MEN1
SCHEMBL2063712 0.73 MPL (0.50) —
SCHEMBL31546885 0.73 NPC1 (0.53) NPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL29598549 0.73 SCN4A (0.50) KDM1APHF8PAX8KDRMEN1

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-2606035-B1 PROCES FOR THE SYNTHESIS OF SUBSTITUTED UREA COMPOUNDS BIAL - PORTELA & CA S A (PT) 2017-09-06 — — EP disclosed
WO-2015016729-A1 UREA COMPOUNDS AND THEIR USE AS FAAH ENZYME INHIBITORS BIAL - PORTELA & Cª, S.A. (PT) 2015-02-05 — — WO disclosed
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