SCHEMBL4821799

SCHEMBL4821799

CCN(CC)C(=O)c1cncc(Br)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.56
▸ HCAR2 Q8TDS4 1/20 0.56
▸ KDM4E B2RXH2 1/20 0.54
▸ HTT P42858 5/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ MAPT P10636 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ HPGD P15428 2/20 0.50
▸ ALOX15 P16050 1/20 0.49
▸ KMT2A Q03164 1/20 0.47
▸ PKM P14618 2/20 0.47
▸ HCRTR1 O43613 1/20 0.45
▸ HCRTR2 O43614 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44

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
SCHEMBL10874128 0.89 POLB (0.49) POLBHCAR2KDM4EHTTSMN1; SMN2
SCHEMBL2570620 0.84 KMT2A (0.55) POLBHCAR2KDM4EHTTSMN1; SMN2
SCHEMBL12677900 0.82 HPGD (0.57) HCAR2SMN1; SMN2MAPTHPGDKMT2A
SCHEMBL1516680 0.81 HTT (0.66) POLBHCAR2KDM4EHTTSMN1; SMN2
SCHEMBL10875034 0.81 POLB (0.47) POLBHCAR2KDM4EHTTSMN1; SMN2
SCHEMBL30964507 0.80 POLB (0.58) POLBHCAR2KDM4EHTTSMN1; SMN2
SCHEMBL5429432 0.80 HPGD (0.49) SMN1; SMN2MAPTRAB9ANPC1TSHR
SCHEMBL9525018 0.79 POLB (0.45) POLBHCAR2KDM4EHTTSMN1; SMN2
SCHEMBL16758459 0.78 POLB (0.60) POLBHCAR2KDM4EHTTSMN1; SMN2
SCHEMBL27690353 0.77 HPGD (0.47) HCAR2SMN1; SMN2MAPTL3MBTL1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208973-A1 TETRACYCLIC COMPOUNDS FOR TREATING BRAIN DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2024-06-27 — — US disclosed
CN-117337289-A Tetracyclic compounds for the treatment of brain disorders 加利福尼亚大学董事会 2024-01-02 — — CN disclosed
US-20230295106-A1 ERGOLINE-LIKE COMPOUNDS FOR PROMOTING NEURAL PLASTICITY DELIX THERAPEUTICS, INC. 2023-09-21 — — US disclosed
US-20230295106-A1 ERGOLINE-LIKE COMPOUNDS FOR PROMOTING NEURAL PLASTICITY DELIX THERAPEUTICS, INC. 2023-09-21 — — US disclosed
US-20230295106-A1 ERGOLINE-LIKE COMPOUNDS FOR PROMOTING NEURAL PLASTICITY DELIX THERAPEUTICS, INC. 2023-09-21 — — US disclosed
WO-2023115060-A1 PSYCHOPLASTOGENS FOR TREATING HEARING-RELATED DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-22 — — WO disclosed
WO-2021076572-A1 ERGOLINE-LIKE COMPOUNDS FOR PROMOTING NEURAL PLASTICITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-04-22 — — WO disclosed
US-20120165356-A1 SPIROCYCLIC HETEROCYCLIC DERIVATIVES AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2012-06-28 — — US disclosed
US-20120165356-A1 SPIROCYCLIC HETEROCYCLIC DERIVATIVES AND METHODS OF THEIR USE ADOLOR CORPORATION (US) 2012-06-28 — — US disclosed
US-8071611-B2 Spirocyclic heterocyclic derivatives and methods of their use ADOLOR CORPORATION (US) 2011-12-06 — — US disclosed
US-7338962-B2 Spirocyclic heterocyclic derivatives and methods of their use ADOLOR CORPORATION (US) 2008-03-04 — — US disclosed
US-20070043089-A1 METHOD OF INHIBITING ANGIOGENESIS HAVIV FORTUNA 2007-02-22 — — US disclosed
US-20070042974-A1 Nozel azalide and azalactam derivatives and method for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2007-02-22 — — US disclosed
US-20070032527-A1 METHOD OF INHIBITING ANGIOGENESIS HAVIV FORTUNA 2007-02-08 — — US disclosed
EP-1661904-A1 NOVEL AZALIDE AND AZALACTAM DERIVATIVES AND PROCESS FOR THE PRODUCTION OF THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2006-05-31 — — EP disclosed
EP-1551404-A2 METHOD OF INHIBITING ANGIOGENESIS Abbott Laboratories (US) 2005-07-13 — — EP disclosed
US-20040116479-A1 Method of inhibiting angiogenesis ABBOTT LABORATORIES 2004-06-17 — — US disclosed
WO-2004032908-A9 METHOD OF INHIBITING ANGIOGENESIS ABBOTT LAB (US) 2004-05-27 — — WO disclosed
WO-2004032908-A2 METHOD OF INHIBITING ANGIOGENESIS ABBOTT LABORATORIES (US) 2004-04-22 — — WO disclosed
US-20040067985-A1 Method of inhibiting angiogenesis ABBOT LABORATORIES 2004-04-08 — — 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 (7 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-20230295106-A1 ERGOLINE-LIKE COMPOUNDS FOR PROMOTING NEURAL PLASTICITY GRIN1, GRIN2A, GRIN3B POLB 4509/4885HCAR2 999/4885KDM4E 2082/4885
US-20070032527-A1 METHOD OF INHIBITING ANGIOGENESIS PGF, VEGFA, FLT4 POLB 1128/4885HCAR2 1694/4885KDM4E 3402/4885
US-20070043089-A1 METHOD OF INHIBITING ANGIOGENESIS PGF, VEGFA, FLT4 POLB 1128/4885HCAR2 1694/4885KDM4E 3402/4885
US-20040067985-A1 Method of inhibiting angiogenesis VEGFA, PGF, FLT4 POLB 1457/4885HCAR2 2104/4885KDM4E 3429/4885
US-20070042974-A1 Nozel azalide and azalactam derivatives and method for producing the same BCL6, NR4A1, NR4A2 POLB 3203/4885HCAR2 585/4885KDM4E 1300/4885
US-20240208973-A1 TETRACYCLIC COMPOUNDS FOR TREATING BRAIN DISORDERS GRIN2A, GRIN2C, DCX POLB 4408/4885HCAR2 581/4885KDM4E 3151/4885
US-20120165356-A1 SPIROCYCLIC HETEROCYCLIC DERIVATIVES AND METHODS OF THEIR USE OPRK1, OPRD1, OPRL1 POLB 4369/4885HCAR2 36/4885KDM4E 4218/4885

“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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