SCHEMBL3758875

SCHEMBL3758875

CC1(C)OB(c2cc(C#N)cc(N3CCOCC3)c2)OC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
HTT P42858 2/20 0.38
LMNA P02545 2/20 0.38
TSHR P16473 2/20 0.38
NSD2 O96028 1/20 0.38
MAPT P10636 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
CASP6 P55212 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPK8 P45983 2/20 0.36
MAPK10 P53779 2/20 0.36
ALK Q9UM73 1/20 0.36
MAPK1 P28482 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
AR P10275 1/20 0.34
KHK P50053 1/20 0.34
MGAT2 Q10469 1/20 0.34
AKT1 P31749 1/20 0.34

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
SCHEMBL31125907 1.00 KDM4E (0.38) KDM4EHTTLMNATSHRNSD2
SCHEMBL12372521 0.89 DRD2 (0.33) KDM4ENSD2ALKALDH1A1SLC6A2
SCHEMBL3753458 0.84 ALK (0.37) KDM4ECASP1CASP7SMN1; SMN2ALK
SCHEMBL2277332 0.82 EGLN2 (0.35) NSD2EGLN2SLC6A2SLC6A4SLC6A3
SCHEMBL3762977 0.82 FFAR4 (0.38) LMNASLC6A9SLC6A5EGLN2
SCHEMBL29925545 0.80 KDM4E (0.39) KDM4EHTTLMNAMAPTMAPK1
SCHEMBL3758794 0.80 LPL (0.40) KDM4EHTTLMNAMAPTSMN1; SMN2
SCHEMBL27032333 0.80 KDM4E (0.39) KDM4EHTTLMNAMAPTMAPK1
SCHEMBL7960738 0.78 ESR2 (0.41)
SCHEMBL4725669 0.78 KDM4E (0.51) KDM4EHTTLMNATSHRNSD2

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-20240316022-A1 INDAZOLE COMPOUNDS TYRA BIOSCIENCES, INC. 2024-09-26 US disclosed
WO-2023279041-A1 INDAZOLE COMPOUNDS TYRA BIOSCIENCES, INC. (US) 2023-01-05 WO disclosed
US-20150232429-A1 SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE 2015-08-20 US disclosed
US-9018205-B2 Substituted pyrimidinyl-amines as protein kinase inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2015-04-28 US disclosed
EP-2200436-B1 SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS SCRIPPS RESEARCH INST (US) 2015-01-21 EP disclosed
US-8530480-B2 Substituted pyrimidinyl-amines as protein kinase inhibitors THE SCRIPPS RESEARCH INSTITUTE (US) 2013-09-10 US disclosed
US-20130231336-A1 SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2013-09-05 US disclosed
US-20100298312-A1 SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2010-11-25 US disclosed
EP-2200436-A1 SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS The Scripps Research Institute (US) 2010-06-30 EP disclosed
WO-2009032861-A1 SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS THE SCRIPPS RESEARCH INSTITUTE (US) 2009-03-12 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 (4 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-20240316022-A1 INDAZOLE COMPOUNDS FGFR1, FGFR3, FGFR2 KDM4E 2639/4885HTT 1776/4885LMNA 4362/4885
US-20130231336-A1 SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS MAP3K20, MAP3K5, MAP3K7 KDM4E 2345/4885HTT 3261/4885LMNA 3037/4885
US-20100298312-A1 SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS MAP3K20, MAP3K5, MAP3K7 KDM4E 2345/4885HTT 3261/4885LMNA 3037/4885
US-20150232429-A1 SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS MAP3K20, MAP3K5, MAP3K7 KDM4E 2345/4885HTT 3261/4885LMNA 3037/4885

“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.