SCHEMBL6808846

SCHEMBL6808846

Cc1ncc(-c2cccc(NC(=O)c3ccc(-c4ccccc4)s3)c2)n1C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.63
TP53 P04637 3/20 0.63
RXFP1 Q9HBX9 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
PPARG P37231 1/20 0.58
NCOA2 Q15596 1/20 0.58
NCOA1 Q15788 1/20 0.58
NCOA3 Q9Y6Q9 1/20 0.58
ESRRG P62508 9/20 0.52
PTPN1 P18031 1/20 0.51
PTPN11 Q06124 1/20 0.51
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ESR1 P03372 5/20 0.48
ESR2 Q92731 3/20 0.48
CLK2 P49760 1/20 0.48
CLK3 P49761 1/20 0.48

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
SCHEMBL6804499 0.92 ESRRG (0.59) MAPTTP53RXFP1SMN1; SMN2NPC1
SCHEMBL6799452 0.89 FYN (0.49) MAPTTP53RXFP1SMN1; SMN2NPC1
SCHEMBL6757951 0.81 DYRK1A (0.46) MAPTTP53RXFP1KDM4EMEN1
SCHEMBL7125139 0.77 ALDH1A1 (0.57) MAPTRXFP1SMN1; SMN2NPC1RAB9A
SCHEMBL6834840 0.76 FYN (0.51) MAPTMEN1KMT2A
SCHEMBL14849810 0.76 NPC1 (1.00) MAPTTP53RXFP1SMN1; SMN2NPC1
SCHEMBL7984129 0.76 FGFR3 (0.42) CLK2CLK3GSK3BDYRK1A
Hydrochloric Acid SCHEMBL7123999 0.75 FGFR3 (0.41) CLK2CLK3GSK3BDYRK1A
SCHEMBL7120305 0.74 KDR (0.60)
SCHEMBL6756808 0.74 GSK3B (0.65) MAPTSMN1; SMN2NPC1RAB9AMEN1

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
US-20040266774-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-30 US disclosed
US-6770667-B1 N-((IMIDAZOLYL)-PHENYL)-FLUORENE-1-CARBOXAMIDE DERIVATIVES; 5-HYDROXYTRYPTAMINE (5-HT) ANTAGONISTS; PSYCHOLOGICAL, NERVOUS SYSTEM, EATING, BRAIN AND SLEEP DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-03 US 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-20040266774-A1 Amide compounds TPH1, HTR1A, HTR5A MAPT 2576/4885TP53 4695/4885RXFP1 211/4885

“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.