SCHEMBL11054072

SCHEMBL11054072

O=C1c2cc3ccccc3nc2C(C(F)(F)F)=CC1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.47
▸ NPC1 O15118 4/20 0.47
▸ MAPT P10636 6/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ ALDH1A1 P00352 5/20 0.40
▸ SMN1; SMN2 Q16637 5/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ MEN1 O00255 4/20 0.40
▸ TP53 P04637 3/20 0.40
▸ CYP3A4 P08684 3/20 0.40
▸ CYP2D6 P10635 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ TOP2A P11388 2/20 0.36
▸ TOP2B Q02880 2/20 0.36
▸ GLA P06280 2/20 0.35
▸ MBNL1 Q9NR56 1/20 0.35
▸ MAPK1 P28482 2/20 0.33
▸ HPGD P15428 2/20 0.33

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
SCHEMBL11054087 0.80 RAB9A (0.51) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL11058831 0.79 NPC1 (0.50) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL6245576 0.69 RAB9A (0.51) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL18462381 0.68 RAB9A (0.93) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL11056089 0.68 NPC1 (0.46) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL3735368 0.67 RAB9A (0.45) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL27492767 0.66 NPC1 (0.47) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL11799472 0.65 NPC1 (0.40) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL11695217 0.65 NPC1 (0.46) RAB9ANPC1MAPTKMT2AALDH1A1
SCHEMBL7464992 0.65 RAB9A (1.00) RAB9ANPC1MAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4474774-A Acridone substituted phosphorus compounds, compositions containing same and insecticidal method of use VELSICOL CHEMICAL CORPORATION (US) 1984-10-02 — — US disclosed
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