SCHEMBL19902276

SCHEMBL19902276

Cc1cc(C)n(-c2nnc(NC(CO[N+](=O)[O-])(CO[N+](=O)[O-])CO[N+](=O)[O-])nn2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.56
RAB9A P51151 3/20 0.56
NPC1 O15118 2/20 0.56
MAPT P10636 7/20 0.44
HTT P42858 5/20 0.44
MAPK1 P28482 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
ALOX15 P16050 4/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
KMT2A Q03164 2/20 0.41
NPSR1 Q6W5P4 4/20 0.36
CYP2C19 P33261 2/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
TDP1 Q9NUW8 2/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
PTPN7 P35236 1/20 0.34
CREBBP Q92793 1/20 0.34

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
SCHEMBL19902273 0.79 SMN1; SMN2 (0.41) SMN1; SMN2RAB9ANPC1MAPTHTT
SCHEMBL17482192 0.78 SMN1; SMN2 (0.70) SMN1; SMN2RAB9ANPC1MAPTHTT
SCHEMBL17482190 0.76 SMN1; SMN2 (0.39) SMN1; SMN2RAB9ANPC1MAPTHTT
SCHEMBL19902242 0.71 ADORA2A (0.32)
SCHEMBL19902454 0.71 KDM4E (0.37)
SCHEMBL19902457 0.70 MAPT (0.33) MAPTKMT2AGAATDP1RECQL
SCHEMBL7694906 0.70 SMN1; SMN2 (0.70) SMN1; SMN2RAB9ANPC1MAPTHTT
SCHEMBL3712068 0.69 RAB9A (0.67) SMN1; SMN2RAB9ANPC1MAPTHTT
SCHEMBL27926814 0.67 SMN1; SMN2 (0.66) SMN1; SMN2RAB9ANPC1MAPTHTT
SCHEMBL28545428 0.65 SMN1; SMN2 (0.45) SMN1; SMN2RAB9ANPC1MAPTHTT

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-10174064-B2 Photoactive energetic materials TRIAD NATIONAL SECURITY, LLC (US) 2019-01-08 US disclosed
US-9902748-B2 Photoactive energetic materials LOS ALAMOS NATIONAL SECURITY, LLC (US) 2018-02-27 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-10174064-B2 Photoactive energetic materials NOX5, TRPM5, MT-ND5 SMN1; SMN2 4635/4885RAB9A 4208/4885NPC1 2726/4885

“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.