SCHEMBL6014446

SCHEMBL6014446

CN(C)c1ccc(-c2cnc(-c3ccc(S(N)(=O)=O)cc3)o2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 11/20 0.68
CA2 P00918 10/20 0.68
CA12 O43570 8/20 0.59
CA9 Q16790 7/20 0.59
PTGS2 P35354 1/20 0.49
NPC1 O15118 2/20 0.49
MEN1 O00255 2/20 0.49
RAB9A P51151 2/20 0.49
KMT2A Q03164 2/20 0.49
POLB P06746 1/20 0.49
HTR6 P50406 1/20 0.47
ALOX15 P16050 2/20 0.47
CASP1 P29466 2/20 0.47
TSHR P16473 1/20 0.46
CA4 P22748 1/20 0.45
FLT1 P17948 1/20 0.45
FLT4 P35916 1/20 0.45
KDR P35968 1/20 0.45
MAOA P21397 2/20 0.44
MAOB P27338 2/20 0.44

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
SCHEMBL6014360 0.88 CA1 (0.51) CA1CA2CA12CA9PTGS2
SCHEMBL12231198 0.88 CA1 (0.51) CA1CA2CA12CA9PTGS2
SCHEMBL6014725 0.86 CA1 (0.50) CA1CA2CA12CA9NPC1
SCHEMBL6014518 0.86 NPC1 (0.50) CA1CA2CA12CA9PTGS2
SCHEMBL20356911 0.85 CA1 (0.49) CA1CA2CA12CA9NPC1
SCHEMBL28884814 0.81 CA2 (1.00) CA1CA2CA12CA9NPC1
SCHEMBL6014405 0.81 HTR6 (0.48) CA1CA2CA12CA9NPC1
SCHEMBL6014540 0.80 CA1 (0.44) CA1CA2CA12CA9NPC1
SCHEMBL1809702 0.80 ALOX15 (0.74) NPC1MEN1RAB9AKMT2AALOX15
SCHEMBL14140425 0.80 ALOX15 (0.54) CA1CA2NPC1MEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7297495-B2 Hybridization-triggered fluorescent detection of nucleic acids EPOCH BIOSCIENCES, INC. (US) 2007-11-20 US disclosed
US-7297495-B2 Hybridization-triggered fluorescent detection of nucleic acids EPOCH BIOSCIENCES, INC. (US) 2007-11-20 US disclosed
US-20070166723-A1 Hybridization-triggered fluorescent detection of nucleic acids EPOCH BIOSCIENCES INC. (US) 2007-07-19 US disclosed
US-20070166723-A1 Hybridization-triggered fluorescent detection of nucleic acids EPOCH BIOSCIENCES INC. (US) 2007-07-19 US disclosed
US-7078406-B2 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes JOHNSON & JOHNSON PHARMACEUTICAL RESEARCH & DEVELOPMENT, L.L.C. (US) 2006-07-18 US disclosed
US-20040248851-A1 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes Life Technologies Corporation 2004-12-09 US disclosed
US-6815445-B2 FOR USE AS FLUORESCENCE DYES AND PROBES Life Technologies Corporation 2004-11-09 US disclosed
EP-1442027-A1 SUBSTITUTED DIPHENYLOXAZOLES, THE SYNTHESIS THEREOF, AND THE USE THEREOF AS FLUORESCENCE PROBES 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2004-08-04 EP disclosed
US-20030105111-A1 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes 3-DIMENSIONAL PHARMACEUTICALS, INC. 2003-06-05 US disclosed
WO-2003031419-A1 SUBSTITUTED DIPHENYLOXAZOLES, THE SYNTHESIS THEREOF, AND THE USE THEREOF AS FLUORESCENCE PROBES 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2003-04-17 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 (3 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-20040248851-A1 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes DHFR, FPR1, CYP1A1 CA1 1667/4885CA2 2598/4885CA12 3043/4885
US-20070166723-A1 Hybridization-triggered fluorescent detection of nucleic acids DDX21, RNGTT, NOP2 CA1 739/4885CA2 692/4885CA12 320/4885
US-20030105111-A1 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes DHFR, FPR1, CYP1A1 CA1 1667/4885CA2 2598/4885CA12 3043/4885

“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.