SCHEMBL18120683

SCHEMBL18120683

Oc1ccccc1Nc1cccc(C(F)(F)F)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.67
RAB9A P51151 2/20 0.67
ALDH1A1 P00352 1/20 0.67
GAA P10253 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
RXFP1 Q9HBX9 2/20 0.61
YAP1 P46937 1/20 0.58
TEAD4 Q15561 1/20 0.58
TEAD2 Q15562 1/20 0.58
P2RX1 P51575 1/20 0.56
IDH2 P48735 2/20 0.55
DHODH Q02127 1/20 0.54
MPO P05164 3/20 0.52
MEN1 O00255 1/20 0.51
HTT P42858 1/20 0.51
KMT2A Q03164 1/20 0.51
KIF11 P52732 2/20 0.50
RAPGEF4 Q8WZA2 1/20 0.50
AKR1C3 P42330 1/20 0.50
AKR1C2 P52895 1/20 0.50

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
SCHEMBL1921484 0.88 MAPT (0.77) MAPTRAB9AALDH1A1GAASMN1; SMN2
SCHEMBL20693799 0.81 ALDH1A1 (0.69) MAPTRAB9AALDH1A1GAASMN1; SMN2
SCHEMBL11566545 0.81 ALDH1A1 (0.68) MAPTRAB9AALDH1A1GAASMN1; SMN2
SCHEMBL1463167 0.80 KDR (0.73) MAPTRAB9AALDH1A1GAARXFP1
SCHEMBL20551660 0.80 GAA (0.67) MAPTRAB9AALDH1A1GAASMN1; SMN2
SCHEMBL29414647 0.80 MAPT (1.00) MAPTRAB9AALDH1A1GAASMN1; SMN2
SCHEMBL10215929 0.80 GAA (0.67) MAPTRAB9AALDH1A1GAASMN1; SMN2
SCHEMBL4064881 0.80 MAPT (1.00) MAPTRAB9AALDH1A1GAASMN1; SMN2
SCHEMBL394991 0.80 KIF11 (0.70) MAPTRAB9AALDH1A1GAASMN1; SMN2
Flufenamic Acid SCHEMBL17497 0.78 RXFP1 (0.75) ALDH1A1RXFP1YAP1TEAD4TEAD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160287549-A1 NOVEL METHODS FOR TREATING NEURODEGENERATIVE DISEASES GENZYME CORPORATION 2016-10-06 US disclosed
CN-101378750-B Indolone compounds useful to treat cognitive impairment HELICON THERAPEUTICS INC 2012-07-18 CN disclosed
CN-101484159-A Method of modulating neurite outgrowth by the use of a galanin-3 receptor antagonist HELICON THERAPEUTICS INC (US) 2009-07-15 CN disclosed
CN-101378750-A Indolone compounds useful to treat cognitive impairment HELICON THERAPEUTICS INC (US) 2009-03-04 CN 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-20160287549-A1 NOVEL METHODS FOR TREATING NEURODEGENERATIVE DISEASES DHODH, DLD, HAGH MAPT 110/4885RAB9A 1351/4885ALDH1A1 162/4885

“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.