SCHEMBL17274876

SCHEMBL17274876

CCCn1c2ccc(Cl)cc2c2cc3ccncc3nc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ CASP1 P29466 2/20 0.40
▸ CASP7 P55210 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HCRTR1 O43613 1/20 0.40
▸ KDM4C Q9H3R0 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.39
▸ PLK1 P53350 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
SCHEMBL17274923 0.87 THRB (0.42) MAPTTDP1CASP1CASP7USP2
SCHEMBL17274871 0.84 POLB (0.56) MAPTTDP1L3MBTL1CASP1CASP7
SCHEMBL18655576 0.84 MAPT (0.57) MAPTTDP1CYP1A2CYP3A4CYP2C9
SCHEMBL17274758 0.84 MAOA (0.54) MAPTTDP1CYP1A2CYP3A4L3MBTL1
SCHEMBL17274925 0.79 MAPT (0.54) MAPTTDP1CYP1A2CYP3A4CYP2C9
SCHEMBL1921824 0.74 PSEN1 (0.57) MAPTLMNAMAPK1KDM4EPLK1
SCHEMBL18655578 0.70 MAPT (0.53) MAPTTDP1CYP1A2CYP3A4CYP2C9
SCHEMBL20340615 0.69 CHUK (0.44) MAPTL3MBTL1TSHRMAPK1KDM4E
SCHEMBL18655577 0.69 MAPT (0.67) MAPTTDP1CYP1A2CYP3A4CYP2C19
SCHEMBL1921889 0.68 ALDH1A1 (0.60) MAPTTDP1CYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10456400-B2 Aza-ellipticine analogs, methods of synthesis and methods of treatment MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2019-10-29 — — US claimed
EP-3145507-A1 AZA-ELLIPTICINE ANALOGS, METHODS OF SYNTHESIS AND METHODS OF TREATMENT Musc Foundation for Research Development (US) 2017-03-29 — — EP claimed
WO-2015179218-A1 AZA-ELLIPTICINE ANALOGS, METHODS OF SYNTHESIS AND METHODS OF TREATMENT MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2015-11-26 — — WO claimed
US-10456400-B2 Aza-ellipticine analogs, methods of synthesis and methods of treatment MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2019-10-29 — — US disclosed
US-10456400-B2 Aza-ellipticine analogs, methods of synthesis and methods of treatment MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2019-10-29 — — US disclosed
US-20170081328-A1 AZA-ELLIPTICINE ANALOGS, METHODS OF SYNTHESIS AND METHODS OF TREATMENT MEDICAL UNIVERSITY OF SOUTH CAROLINA 2017-03-23 — — US disclosed
US-20170081328-A1 AZA-ELLIPTICINE ANALOGS, METHODS OF SYNTHESIS AND METHODS OF TREATMENT MEDICAL UNIVERSITY OF SOUTH CAROLINA 2017-03-23 — — US disclosed
US-20170081328-A1 AZA-ELLIPTICINE ANALOGS, METHODS OF SYNTHESIS AND METHODS OF TREATMENT MEDICAL UNIVERSITY OF SOUTH CAROLINA 2017-03-23 — — US disclosed
WO-2015179218-A1 AZA-ELLIPTICINE ANALOGS, METHODS OF SYNTHESIS AND METHODS OF TREATMENT MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2015-11-26 — — 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 (2 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-20170081328-A1 AZA-ELLIPTICINE ANALOGS, METHODS OF SYNTHESIS AND METHODS OF TREATMENT AZI2, DNMT1, TET3 MAPT 3584/4885TDP1 1327/4885CYP1A2 31/4885
US-10456400-B2 Aza-ellipticine analogs, methods of synthesis and methods of treatment AZI2, DNMT1, TET3 MAPT 3584/4885TDP1 1327/4885CYP1A2 31/4885

“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.

Send feedback