SCHEMBL5990747

SCHEMBL5990747

Cc1ccc2nc(C(C)C)[nH]c2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
HSD17B10 Q99714 2/20 0.43
LMNA P02545 2/20 0.43
CYP1A2 P05177 2/20 0.38
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
USP2 O75604 1/20 0.35
HTT P42858 1/20 0.35
PARG Q86W56 1/20 0.35
KMT2A Q03164 1/20 0.34
TGFBR1 P36897 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
GSK3B P49841 1/20 0.33
CCNB2 O95067 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33

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
SCHEMBL12599167 0.82 SCN10A (0.39) KDM4EHSD17B10CYP1A2ALDH1A1HPGD
SCHEMBL798830 0.81 KDM4E (0.43) KDM4EHSD17B10LMNACYP1A2ALDH1A1
SCHEMBL12232006 0.77 KDM4E (0.40) KDM4EHSD17B10LMNACYP1A2ALDH1A1
SCHEMBL18949090 0.77 KDM4E (0.40) KDM4EHSD17B10LMNACYP1A2ALDH1A1
SCHEMBL18238341 0.76 KDM4E (0.42) KDM4EHSD17B10LMNACYP1A2ALDH1A1
SCHEMBL2756734 0.75 ALDH1A1 (0.42) KDM4EHSD17B10LMNACYP1A2ALDH1A1
SCHEMBL12938120 0.75 KDM4E (0.48) KDM4EHSD17B10LMNACYP1A2ALDH1A1
SCHEMBL13561551 0.75 KDM4E (0.39) KDM4EHSD17B10LMNACYP1A2ALDH1A1
SCHEMBL12327988 0.75 CCR1 (0.45) KDM4EHSD17B10LMNACYP1A2ALDH1A1
SCHEMBL18949108 0.74 KDM4E (0.38) KDM4EHSD17B10LMNACYP1A2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2023-11-23 US disclosed
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 US disclosed
US-20230050819-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-02-16 US disclosed
US-20220402894-A1 Phthalazine Derivatives as Inhibitors of PARP1, PARP2, and/or Tubulin Useful for the Treatment of Cancer ATLASMEDX, INC. 2022-12-22 US disclosed
US-20120115918-A1 Anti-Viral Compounds ABBOTT LABORATORIES (US) 2012-05-10 US disclosed
US-20120039848-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2012-02-16 US disclosed
US-20110250172-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-10-13 US disclosed
US-20110189129-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-08-04 US disclosed
US-20110142798-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-06-16 US disclosed
US-20100317568-A1 Anti-Viral Compounds Abbott Labaoratories (US) 2010-12-16 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 (10 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-20100317568-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS KDM4E 2318/4885HSD17B10 2002/4885LMNA 3118/4885
US-20220402894-A1 Phthalazine Derivatives as Inhibitors of PARP1, PARP2, and/or Tubulin Useful for the Treatment of Cancer PARP2, PARP12, PARP1 KDM4E 2587/4885HSD17B10 1530/4885LMNA 1010/4885
US-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR KDM4E 4095/4885HSD17B10 1287/4885LMNA 1249/4885
US-20110250172-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 KDM4E 1193/4885HSD17B10 581/4885LMNA 2800/4885
US-20120039848-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 KDM4E 1193/4885HSD17B10 581/4885LMNA 2800/4885
US-20120115918-A1 Anti-Viral Compounds HAVCR2, EIF2AK2, MAVS KDM4E 2318/4885HSD17B10 2002/4885LMNA 3118/4885
US-20230050819-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE CYFIP2, TPX2, ATXN2 KDM4E 2182/4885HSD17B10 2804/4885LMNA 1719/4885
US-20110189129-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, HCCS, NSUN2 KDM4E 1321/4885HSD17B10 1474/4885LMNA 886/4885
US-20110142798-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 KDM4E 1193/4885HSD17B10 581/4885LMNA 2800/4885
US-20230373972-A1 PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF F7, F11, HABP2 KDM4E 1788/4885HSD17B10 2108/4885LMNA 1614/4885

“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.