SCHEMBL19437465

SCHEMBL19437465

Cc1cc(C(N)=O)cc([N+](=O)[O-])c1Cl

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
POLB P06746 1/20 0.53
PARP1 P09874 1/20 0.50
CYP3A4 P08684 1/20 0.50
ALDH1A1 P00352 3/20 0.48
ATM Q13315 1/20 0.48
TSHR P16473 4/20 0.47
VCAM1 P19320 1/20 0.45
GPR35 Q9HC97 1/20 0.44
HSP90AA1 P07900 1/20 0.44
MAPT P10636 1/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
GAA P10253 1/20 0.42
PKM P14618 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CTPS1 P17812 1/20 0.42

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
SCHEMBL6570802 0.87 CYP3A4 (0.59) LMNASMN1; SMN2POLBPARP1CYP3A4
SCHEMBL28155919 0.86 TSHR (0.47) LMNASMN1; SMN2POLBCYP3A4ALDH1A1
SCHEMBL10609914 0.86 TSHR (0.60) LMNAPOLBALDH1A1TSHRVCAM1
SCHEMBL31161445 0.82 LMNA (0.53) LMNASMN1; SMN2POLBALDH1A1TSHR
SCHEMBL10608607 0.82 LMNA (0.53) LMNASMN1; SMN2POLBALDH1A1TSHR
SCHEMBL4638638 0.82 SMN1; SMN2 (0.57) LMNASMN1; SMN2POLBPARP1CYP3A4
SCHEMBL21643830 0.81 PARP1 (0.49) LMNASMN1; SMN2POLBPARP1CYP3A4
SCHEMBL1002938 0.81 CYP3A4 (0.48) LMNASMN1; SMN2POLBPARP1CYP3A4
SCHEMBL19436436 0.81 CYP3A4 (0.52) LMNASMN1; SMN2POLBPARP1CYP3A4
SCHEMBL10606064 0.80 KMT2A (0.53) LMNASMN1; SMN2POLBALDH1A1HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10975287-B2 Heterocyclic amides useful as protein modulators GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED 2021-04-13 US disclosed
US-10975287-B2 Heterocyclic amides useful as protein modulators GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED 2021-04-13 US disclosed
US-20200325126-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-10-15 US disclosed
US-20200325126-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-10-15 US disclosed
WO-2020132582-A1 STING AGONISTS AND USES THEREOF NIMBUS TITAN, INC. (US) 2020-06-25 WO disclosed
EP-3440072-B1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-01-29 EP disclosed
EP-3440072-B1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-01-29 EP disclosed
EP-3440072-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2019-02-13 EP disclosed
US-20180105514-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-04-19 US disclosed
WO-2017175156-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-12 WO disclosed
WO-2017175156-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-12 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-20200325126-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS ARGLU1, G3BP1, G3BP2 LMNA 4628/4885SMN1; SMN2 3690/4885POLB 4745/4885
US-10975287-B2 Heterocyclic amides useful as protein modulators ARGLU1, G3BP1, G3BP2 LMNA 4628/4885SMN1; SMN2 3690/4885POLB 4745/4885
US-20180105514-A1 HETEROCYCLIC AMIDES USEFUL AS PROTEIN MODULATORS RB1, RBBP5, RCC2 LMNA 4217/4885SMN1; SMN2 2058/4885POLB 3524/4885

“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.