SCHEMBL30459372

SCHEMBL30459372

O=C(Oc1c(Cl)cc(Cl)cc1Cl)C(=O)Oc1c(Cl)cc(Cl)cc1Cl.O=C(Oc1c(Cl)cc([N+](=O)[O-])cc1Cl)C(=O)Oc1c(Cl)cc([N+](=O)[O-])cc1Cl.O=C(Oc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C(=O)Oc1ccc([N+](=O)[O-])c(C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.45
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TTR P02766 1/20 0.39
PPOX P50336 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
AR P10275 6/20 0.39
CYP3A4 P08684 2/20 0.39
LMNA P02545 2/20 0.39
TSHR P16473 2/20 0.39
MAPK1 P28482 2/20 0.39
CES2 O00748 1/20 0.39
ABCB11 O95342 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
GLA P06280 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
CHRM1 P11229 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL7151785 0.95 AR (0.42) NR1H4MEN1KMT2ATTRPPOX
SCHEMBL429387 0.84 AR (0.50) ARCYP3A4LMNATSHRMAPK1
SCHEMBL31572516 0.84 AR (0.50) ARCYP3A4LMNATSHRMAPK1
SCHEMBL25310100 0.79 ALDH1A1 (0.52) NR1H4MEN1KMT2ATDP1CYP3A4
SCHEMBL31694580 0.78 AR (0.47) MEN1KMT2ATTRPPOXTDP1
SCHEMBL430731 0.76 ALDH1A1 (0.55) NR1H4MEN1KMT2ATDP1CYP3A4
SCHEMBL11223044 0.74 AR (0.46) MEN1KMT2ATTRPPOXTDP1
SCHEMBL5389110 0.74 AR (0.45) MEN1KMT2ATTRPPOXTDP1
SCHEMBL5382654 0.72 TDP1 (0.43) MEN1KMT2ATTRPPOXTDP1
SCHEMBL11159312 0.72 TDP1 (0.59) MEN1KMT2ATTRPPOXTDP1

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
EP-4352449-A2 PROJECTILE PAYLOAD FOR TRAINING AMMUNITION WITH MULTI-SPECTRAL OUTPUT Cyalume Technologies, Inc (US) 2024-04-17 EP claimed
WO-2023140886-A2 PROJECTILE PAYLOAD FOR TRAINING AMMUNITION WITH MULTI-SPECTRAL OUTPUT CYALUME TECHNOLOGIES, INC. (US) 2023-07-27 WO claimed