SCHEMBL1997897

SCHEMBL1997897

Cc1ccccc1NNCl

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.54
KDM4E B2RXH2 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 3/20 0.50
MAPT P10636 2/20 0.50
POLB P06746 2/20 0.50
HTT P42858 1/20 0.50
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
HPGD P15428 3/20 0.45
TSHR P16473 1/20 0.43
ACHE P22303 1/20 0.43
P2RX7 Q99572 5/20 0.41
CRHR1 P34998 1/20 0.40

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
Hydrochloric Acid SCHEMBL18172145 0.98 GAA (0.52) GAAKDM4ETDP1ALDH1A1MAPT
SCHEMBL9355162 0.84 GAA (0.62) GAAKDM4ETDP1ALDH1A1MAPT
SCHEMBL4257297 0.79
SCHEMBL31129158 0.79
SCHEMBL2467696 0.77 GAA (0.56) GAAKDM4ETDP1ALDH1A1MAPT
Ammonia Solution, Strong SCHEMBL28853279 0.77 MAPT (0.52) GAAKDM4ETDP1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL10693971 0.75 GAA (0.54) GAAKDM4ETDP1ALDH1A1MAPT
SCHEMBL21876496 0.75 GAA (0.54) GAAKDM4ETDP1ALDH1A1MAPT
SCHEMBL7869240 0.73 ALDH1A1 (0.57) GAAKDM4ETDP1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL18172098 0.73 GAA (0.52) GAAKDM4ETDP1ALDH1A1MAPT

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170326125-A1 MULTISUBSTITUTED AROMATIC COMPOUNDS AS INHIBITORS OF THROMBIN VERSEON INTERNATIONAL CORPORATION 2017-11-16 US disclosed
US-9799834-B2 Carbazole compound light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-10-24 US disclosed
US-20170288153-A1 Light-Emitting Element and Electronic Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-10-05 US disclosed
US-20170253796-A1 Light-Emitting Element, Light-Emitting Device, Electronic Device, Lighting Device, and Novel Organic Compound SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-09-07 US disclosed
US-9735372-B2 Light-emitting element and electronic device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-08-15 US disclosed
US-9663711-B2 Light-emitting element, light-emitting device, electronic device, lighting device, and novel organic compound SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2017-05-30 US disclosed
US-9406894-B2 Organometallic complex, organic light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-08-02 US disclosed
US-20150318491-A1 CARBAZOLE COMPUND LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2015-11-05 US disclosed
US-20150287934-A1 Light-Emitting Element and Electronic Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-10-08 US disclosed
US-9065058-B2 Light-emitting element and electronic device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-06-23 US disclosed
US-20110269763-A1 CRTH2 receptor ligands for medicinal uses 7TM PHARMA A/S (DK) 2011-11-03 US disclosed
US-8022063-B2 CRTH2 receptor ligands for medicinal uses 7TM PHARMA A/S (DK) 2011-09-20 US disclosed
EP-2336113-A1 CRTH2 Receptor Ligands for Medical Use 7TM Pharma A/S (DK) 2011-06-22 EP disclosed
US-20090099189-A1 CRTH2 Receptor Ligands For Medicinal Uses 7TM PHARMA A/S (DK) 2009-04-16 US disclosed
EP-1758579-A1 CRTH2 RECEPTOR LIGANDS FOR MEDICINAL USES 7TM Pharma A/S (DK) 2007-03-07 EP disclosed
WO-2005115382-A1 CRTH2 RECEPTOR LIGANDS FOR MEDICINAL USES 7TM PHARMA A/S (DK) 2005-12-08 WO disclosed
US-4448961-A Substituted anilino pyrimidines ZOECON CORPORATION (US) 1984-05-15 US disclosed
US-4411839-A α-Cyano-β-(trisubstituted phenylhydrazino)-n-ethoxycarbonylacrylamides ZOECON CORPORATION (US) 1983-10-25 US disclosed
US-4045169-A FLUORESCENT DYES HOECHST AKTIENGESELLSCHAFT (DT) 1977-08-30 US disclosed
US-3957815-A 3-[3',4'-Dichloro-6'-alkyl-phenyl]-Δ2 -pyrazoline derivatives and their use as optical brighteners HOECHST AKTIENGESELLSCHAFT (DT) 1976-05-18 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 (5 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-20150318491-A1 CARBAZOLE COMPUND LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE CYP1A1, GPER1, CRY1 GAA 3971/4885KDM4E 4565/4885TDP1 3054/4885
US-20170326125-A1 MULTISUBSTITUTED AROMATIC COMPOUNDS AS INHIBITORS OF THROMBIN TFPI, PLAT, SERPINC1 GAA 569/4885KDM4E 2301/4885TDP1 388/4885
US-20150287934-A1 Light-Emitting Element and Electronic Device SLC39A3, SLC19A2, SLC39A14 GAA 2865/4885KDM4E 2737/4885TDP1 2672/4885
US-20090099189-A1 CRTH2 Receptor Ligands For Medicinal Uses HRH1, HRH2, HRH3 GAA 4427/4885KDM4E 4637/4885TDP1 4874/4885
US-20110269763-A1 CRTH2 receptor ligands for medicinal uses HRH1, HRH2, HRH4 GAA 4385/4885KDM4E 4520/4885TDP1 4873/4885

“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.