SCHEMBL3198506

SCHEMBL3198506

COCCn1ccc2c[c]ccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 2/20 0.39
CDK4 P11802 4/20 0.38
CCND1 P24385 4/20 0.38
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
GRIN2B Q13224 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
USP2 O75604 1/20 0.33
MAPK1 P28482 1/20 0.33
HTR6 P50406 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
TP53 P04637 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL5778093 0.91 GLO1 (0.41) GLO1CDK4CCND1HTR2AHTR2C
SCHEMBL13726782 0.87 CDK4 (0.38) GLO1CDK4CCND1HTR2AHTR2C
SCHEMBL6231638 0.83 HTR2C (0.33) CDK4CCND1HTR2AHTR2C
SCHEMBL694594 0.81 CDK4 (0.41) CDK4CCND1HTR2AHTR2CMAPK1
SCHEMBL5777899 0.81 MAPK1 (0.39) CDK4CCND1MEN1KMT2ANPC1
SCHEMBL5814894 0.79 CDK4 (0.44) CDK4CCND1HTR2AHTR2CGRIN2B
SCHEMBL5778193 0.78 CDK4 (0.41) GLO1CDK4CCND1HTR2AHTR2C
SCHEMBL1450476 0.78 CDK4 (0.41) CDK4CCND1HTR2AHTR2CMEN1
SCHEMBL27382849 0.78 CDK4 (0.41) CDK4CCND1HTR2AHTR2CMAPK1
SCHEMBL5780811 0.78 LMNA (0.41) MEN1KMT2ANPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240116910-A1 Heterocycles as WIP1 Inhibitors PMV PHARMACEUTICALS, INC. 2024-04-11 US claimed
US-20240116910-A1 Heterocycles as WIP1 Inhibitors PMV PHARMACEUTICALS, INC. 2024-04-11 US disclosed
US-7667036-B2 MAPKAP-K2 (mitogen-activated protein kinase-activated protein kinase 2) inhibitors; inflammatory, autoimmune disease, destructive bone disorder, cancer and/or tumor growth; angiogenesis, diabetes and neurological disorders TEIJIN PHARMA LIMITED (JP) 2010-02-23 US disclosed
EP-1780212-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVE Teijin Pharma Limited (JP) 2007-05-02 EP disclosed
US-20060135514-A1 Pyrazolo[1,5-a]pyrimidine derivatives TEIJIN PHARMA LIMITED 2006-06-22 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 (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-20240116910-A1 Heterocycles as WIP1 Inhibitors WAPL, WHR1, G3BP1 GLO1 2910/4885CDK4 262/4885CCND1 675/4885
US-20060135514-A1 Pyrazolo[1,5-a]pyrimidine derivatives MAPKAPK2, MAPKAPK5, MAP4K2 GLO1 4564/4885CDK4 538/4885CCND1 768/4885

“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.