SCHEMBL7420189

SCHEMBL7420189

O=C(NCc1ccc(F)cc1)Nc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 1.00
NPC1 O15118 5/20 1.00
POLB P06746 2/20 1.00
MAOB P27338 2/20 1.00
KMT2A Q03164 3/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
MEN1 O00255 2/20 0.71
TP53 P04637 1/20 0.71
HPGD P15428 1/20 0.71
ALDH1A1 P00352 2/20 0.68
HTT P42858 1/20 0.67
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
GAA P10253 2/20 0.63
RORC P51449 1/20 0.60
NAMPT P43490 1/20 0.58

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
SCHEMBL8180564 0.93 RAB9A (0.88) RAB9ANPC1POLBMAOBKMT2A
SCHEMBL23747477 0.88 RAB9A (0.78) RAB9ANPC1POLBMAOBKMT2A
SCHEMBL2831462 0.88 NPC1 (0.77) RAB9ANPC1POLBMAOBKMT2A
SCHEMBL20911008 0.86 RAB9A (0.75) RAB9ANPC1POLBMAOBKMT2A
SCHEMBL26099259 0.86 RAB9A (0.75) RAB9ANPC1POLBMAOBKMT2A
SCHEMBL17000091 0.85 NPC1 (0.73) RAB9ANPC1POLBMAOBKMT2A
SCHEMBL14025738 0.85 NPC1 (0.73) RAB9ANPC1POLBMAOBKMT2A
SCHEMBL26546719 0.84 RAB9A (0.73) RAB9ANPC1POLBMAOBKMT2A
SCHEMBL16946645 0.84 NPC1 (0.84) RAB9ANPC1POLBMAOBKMT2A
SCHEMBL13720058 0.83 NPC1 (1.00) RAB9ANPC1POLBMAOBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112574070-B Synthesis method of substituted urea compound 西华大学 2022-11-08 CN disclosed
CN-112574070-A Synthesis method of substituted urea compound 西华大学 2021-03-30 CN disclosed
US-20190284171-A1 METHOD OF CONVERTING CARBON DIOXIDE INTO CARBONYL COMPOUNDS TRANSLATIONAL HEALTH SCIENCE AND TECHNOLOGY INSTITUTE (IN) 2019-09-19 US disclosed
WO-2019073484-A1 METHOD OF CONVERTING CARBON DIOXIDE INTO CARBONYL COMPOUNDS TRANSLATIONAL HEALTH SCIENCE AND TECHNOLOGY INSTITUTE (IN) 2019-04-18 WO disclosed
EP-0874823-A1 TRI-SUBSTITUTED PHENYL DERIVATIVES USEFUL AS PDE IV INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1998-11-04 EP disclosed
WO-1997023460-A1 TRI-SUBSTITUTED PHENYL DERIVATIVES USEFUL AS PDE IV INHIBITORS CELLTECH THERAPEUTICS LIMITED (GB) 1997-07-03 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190284171-A1 METHOD OF CONVERTING CARBON DIOXIDE INTO CARBONYL COMPOUNDS CBR3, CBR1, NOX3 RAB9A 3010/4885NPC1 934/4885POLB 1459/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.