SCHEMBL1115838

SCHEMBL1115838

Cn1cnc2cc(N)c([N+](=O)[O-])cc2c1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ EGFR P00533 1/20 0.40
▸ IP6K1 Q92551 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ NPC1 O15118 2/20 0.38
▸ HTT P42858 4/20 0.38
▸ MAPT P10636 3/20 0.38
▸ LMNA P02545 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ ACVR1 Q04771 2/20 0.38
▸ POLB P06746 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ MPI P34949 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37

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
SCHEMBL21892099 0.76 L3MBTL1 (0.46) L3MBTL1IP6K1KDM4EACVR1
SCHEMBL19185810 0.74 L3MBTL1 (1.00) L3MBTL1IP6K1KDM4EHTTMAPT
SCHEMBL7222755 0.71 PARP1 (0.56) EGFRIP6K1SMN1; SMN2MAPTNPSR1
SCHEMBL20127277 0.70 EGFR (0.52) L3MBTL1EGFRMAPTLMNAPOLB
SCHEMBL4252815 0.69 L3MBTL1 (0.59) L3MBTL1IP6K1KDM4ESMN1; SMN2ACVR1
SCHEMBL15680577 0.68 L3MBTL1 (0.50) L3MBTL1IP6K1KDM4EACVR1
SCHEMBL1115720 0.68 MAPT (0.47) KDM4ESMN1; SMN2RAB9AHTTMAPT
SCHEMBL1115798 0.67 MAPT (0.76) L3MBTL1KDM4ESMN1; SMN2HTTMAPT
SCHEMBL9679622 0.67 MAPT (0.50) L3MBTL1KDM4ESMN1; SMN2GAARAB9A
SCHEMBL3881328 0.67 L3MBTL1 (0.74) L3MBTL1IP6K1KDM4EHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8262949-B2 Long wavelength shifted benzotriazole uv-absorbers and their use BASF SE (DE) 2012-09-11 — — US disclosed
US-8262949-B2 Long wavelength shifted benzotriazole uv-absorbers and their use BASF SE (DE) 2012-09-11 — — US disclosed
US-8262949-B2 Long wavelength shifted benzotriazole uv-absorbers and their use BASF SE (DE) 2012-09-11 — — US disclosed
EP-2032577-B1 LONG WAVELENGTH SHIFTED BENZOTRIAZOLE UV-ABSORBERS AND THEIR USE BASF SE (DE) 2011-02-02 — — EP disclosed
US-20100163813-A1 Long wavelength shifted benzotriazole uv-absorbers and their use CIBA CORPORATION 2010-07-01 — — US disclosed
US-20100163813-A1 Long wavelength shifted benzotriazole uv-absorbers and their use CIBA CORPORATION 2010-07-01 — — US disclosed
US-20100163813-A1 Long wavelength shifted benzotriazole uv-absorbers and their use CIBA CORPORATION 2010-07-01 — — 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-20100163813-A1 Long wavelength shifted benzotriazole uv-absorbers and their use SULT1A1, GABBR1, TPMT L3MBTL1 3864/4885EGFR 4053/4885IP6K1 3586/4885

“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.

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