SCHEMBL18177873

SCHEMBL18177873

O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(C2CCN(Cc3ccccc3)CC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 1.00
POLB P06746 1/20 0.79
SMN1; SMN2 Q16637 3/20 0.61
RECQL P46063 1/20 0.61
ALDH1A1 P00352 6/20 0.61
KDM4E B2RXH2 4/20 0.61
PKM P14618 1/20 0.57
MEN1 O00255 1/20 0.56
NPC1 O15118 1/20 0.52
MAPK1 P28482 1/20 0.52

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
SCHEMBL2360974 0.78 ALDH1A1 (0.84) KMT2APOLBSMN1; SMN2ALDH1A1PKM
SCHEMBL17007485 0.77 KMT2A (0.62) KMT2APOLBSMN1; SMN2ALDH1A1KDM4E
SCHEMBL29004530 0.77 POLB (0.76) KMT2APOLBSMN1; SMN2ALDH1A1KDM4E
SCHEMBL30343311 0.77 POLB (0.76) KMT2APOLBSMN1; SMN2ALDH1A1KDM4E
SCHEMBL3958348 0.76 KMT2A (0.65) KMT2APOLBSMN1; SMN2RECQLALDH1A1
SCHEMBL26258912 0.76 POLB (0.76) KMT2APOLBSMN1; SMN2ALDH1A1KDM4E
SCHEMBL18181908 0.76 SMN1; SMN2 (1.00) KMT2APOLBSMN1; SMN2RECQLALDH1A1
SCHEMBL18177839 0.76 SMN1; SMN2 (0.74) KMT2APOLBSMN1; SMN2RECQLALDH1A1
SCHEMBL5038499 0.75 POLB (0.63) KMT2APOLBALDH1A1KDM4EPKM
SCHEMBL5068102 0.74 KMT2A (0.59) KMT2APOLBSMN1; SMN2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage WASE, NISHIKANT 2020-03-05 US disclosed
US-10351883-B2 Compounds for increasing lipid synthesis and storage NUTECH VENTURES (US) 2019-07-16 US disclosed
US-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage INVITROGEN CORPORATION 2016-10-27 US disclosed
US-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage INVITROGEN CORPORATION 2016-10-27 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 (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-20160312253-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 KMT2A 2512/4885POLB 3520/4885SMN1; SMN2 4517/4885
US-10351883-B2 Compounds for increasing lipid synthesis and storage FASN, LIPC, SREBF2 KMT2A 2512/4885POLB 3520/4885SMN1; SMN2 4517/4885
US-20200071735-A1 Compounds for Increasing Lipid Synthesis and Storage FASN, LIPC, SREBF2 KMT2A 2512/4885POLB 3520/4885SMN1; SMN2 4517/4885

“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.