SCHEMBL22686240

SCHEMBL22686240

Cc1cccc(F)c1N1CCC(NC(=O)O)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
SIGMAR1 Q99720 3/20 0.43
ALDH1A1 P00352 3/20 0.43
CCNE1 P24864 1/20 0.43
CDK2 P24941 1/20 0.43
FFAR1 O14842 1/20 0.42
EED O75530 1/20 0.42
POLB P06746 1/20 0.41
C5AR1 P21730 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
EPHX2 P34913 1/20 0.40
NPY5R Q15761 1/20 0.40

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
SCHEMBL27148465 0.84 CKS1B (0.49) L3MBTL1KMT2A
SCHEMBL30851816 0.82 CCNE1 (0.50) ALDH1A1CCNE1CDK2POLBRAB9A
SCHEMBL20140934 0.82 ALDH1A1 (0.48) L3MBTL1SIGMAR1ALDH1A1C5AR1
SCHEMBL30852024 0.79 PIK3CD (0.48) CCNE1CDK2
SCHEMBL30852044 0.79 KMT2A (0.48) L3MBTL1ALDH1A1CCNE1CDK2POLB
SCHEMBL27307706 0.77 SLC6A2 (0.42) ALDH1A1FFAR1POLBC5AR1KMT2A
SCHEMBL30852175 0.76 FFAR1 (0.44) FFAR1C5AR1
SCHEMBL28703207 0.76 SSTR2 (0.43) ALDH1A1POLBC5AR1KMT2AMEN1
Hydrochloric Acid SCHEMBL30852171 0.75 SSTR2 (0.42) ALDH1A1POLBC5AR1KMT2AMEN1
SCHEMBL23573437 0.74 L3MBTL1 (0.52) L3MBTL1CDK2POLBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192708-A1 2,4,6,7-TETRAHYDRO-PYRAZOLO[4,3-D]PYRIMIDIN-5-ONE DERIVATIVES AND RELATED COMPOUNDS AS C5A RECEPTOR MODULATORS FOR TREATING VASCULITIS AND INFLAMMATORY DISEASES IDORSIA PHARMACEUTICALS LTD (CH) 2023-06-22 US disclosed
US-11608341-B2 Substituted tetrahydropyrazolo[3,4-d]pyrimidines and tetrahydropyrazolo[4,3-d]pyrimidines as C5A receptor modulators IDORSIA PHARMACEUTICALS LTD. (CH) 2023-03-21 US disclosed
US-20200369672-A1 2,4,6,7-TETRAHYDRO-PYRAZOLO[4,3-D]PYRIMIDIN-5-ONE DERIVATIVES AND RELATED COMPOUNDS AS C5A RECEPTOR MODULATORS FOR TREATING VASCULITIS AND INFLAMMATORY DISEASES IDORSIA PHARMACEUTICALS LTD. (CH) 2020-11-26 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-20200369672-A1 2,4,6,7-TETRAHYDRO-PYRAZOLO[4,3-D]PYRIMIDIN-5-ONE DERIVATIVES AND RELATED COMPOUNDS AS C5A RECEPTOR MODULATORS FOR TREATING VASCULITIS AND INFLAMMATORY DISEASES C3AR1, C5AR1, C5AR2 L3MBTL1 4871/4885SIGMAR1 1141/4885ALDH1A1 2010/4885
US-20230192708-A1 2,4,6,7-TETRAHYDRO-PYRAZOLO[4,3-D]PYRIMIDIN-5-ONE DERIVATIVES AND RELATED COMPOUNDS AS C5A RECEPTOR MODULATORS FOR TREATING VASCULITIS AND INFLAMMATORY DISEASES C3AR1, C5AR1, C5AR2 L3MBTL1 4871/4885SIGMAR1 1141/4885ALDH1A1 2010/4885
US-11608341-B2 Substituted tetrahydropyrazolo[3,4-d]pyrimidines and tetrahydropyrazolo[4,3-d]pyrimidines as C5A receptor modulators C5AR1, C3AR1, C5AR2 L3MBTL1 4822/4885SIGMAR1 887/4885ALDH1A1 3015/4885

“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.