SCHEMBL2880358

SCHEMBL2880358

Nc1ccc(C=C2CNCS2)cc1NCc1ccoc1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.32
PIM1 P11309 1/20 0.31
DYRK1A Q13627 1/20 0.31
DYRK2 Q92630 1/20 0.31
DYRK1B Q9Y463 1/20 0.31

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
SCHEMBL2882234 0.75 GAA (0.41) HPGD
SCHEMBL2881875 0.72 HTR2A (0.33)
SCHEMBL9698200 0.65 HPGD (0.46) HPGD
SCHEMBL6298689 0.61 HPGD (0.42) HPGDPIM1DYRK1ADYRK2DYRK1B
SCHEMBL6297594 0.61 HPGD (0.52) HPGDPIM1DYRK1ADYRK2DYRK1B
Hydrochloric Acid SCHEMBL6304434 0.60 HPGD (0.51) HPGDPIM1DYRK1ADYRK2DYRK1B
Hydrochloric Acid SCHEMBL6298737 0.60 HPGD (0.41) HPGDPIM1DYRK1ADYRK2DYRK1B
SCHEMBL6523611 0.58 PIM1 (0.39) HPGDPIM1
SCHEMBL3877400 0.56 APP (0.40) HPGD
SCHEMBL454948 0.56 HPGD (0.53) HPGDPIM1DYRK1ADYRK2DYRK1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 US disclosed
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2006-06-08 US disclosed
US-20050222225-A1 Use of compounds for increasing spermatozoa motility APPLIED RESEARCH SYSTEMS ARS HOLDING NV (NL) 2005-10-06 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 (3 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-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES ZAP70, BRCA1, ZYX HPGD 2011/4885PIM1 2247/4885DYRK1A 3161/4885
US-20050222225-A1 Use of compounds for increasing spermatozoa motility CATSPER1, PI4KB, MAN2B2 HPGD 3176/4885PIM1 2811/4885DYRK1A 4508/4885
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives BRCA1, ZAP70, F13B HPGD 2135/4885PIM1 2412/4885DYRK1A 3215/4885

“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.