SCHEMBL6014354

SCHEMBL6014354

CC=CNCCCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.57
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.52
POLB P06746 2/20 0.50
ATM Q13315 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HPGD P15428 1/20 0.46

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
SCHEMBL6615894 0.96 SIGMAR1 (0.53) SIGMAR1KMT2AMEN1L3MBTL1POLB
SCHEMBL13373174 0.90 TAAR1 (0.54) SIGMAR1KMT2AMEN1L3MBTL1ATM
SCHEMBL6014395 0.88 KMT2A (0.44) SIGMAR1KMT2AMEN1L3MBTL1POLB
SCHEMBL10937019 0.78 SIGMAR1 (0.55) SIGMAR1KMT2AMEN1L3MBTL1POLB
SCHEMBL1356645 0.78 SIGMAR1 (0.65) SIGMAR1KMT2AMEN1L3MBTL1
SCHEMBL19711877 0.78 SIGMAR1 (0.59) SIGMAR1KMT2AMEN1L3MBTL1POLB
SCHEMBL8916941 0.78 SIGMAR1 (0.59) SIGMAR1KMT2AMEN1L3MBTL1POLB
SCHEMBL14159090 0.77 ADH1B (0.56) SIGMAR1KMT2AMEN1HPGD
SCHEMBL12605372 0.77 ADH1B (0.56) SIGMAR1KMT2AMEN1HPGD
Hydrochloric Acid SCHEMBL2493107 0.76 SIGMAR1 (0.57) SIGMAR1KMT2AMEN1L3MBTL1POLB

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
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 (2 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 SIGMAR1 1287/4885KMT2A 1404/4885MEN1 2372/4885
US-20030105111-A1 Substituted diphenyloxazoles, the synthesis thereof, and the use thereof as fluorescence probes DHFR, FPR1, CYP1A1 SIGMAR1 1287/4885KMT2A 1404/4885MEN1 2372/4885

“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.