SCHEMBL4483774

SCHEMBL4483774

CC(C)S(=O)(=O)c1ccccc1[C@H]1[C@@H](C(=O)O)CCN1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.35
BCHE P06276 2/20 0.35
PTK2 Q05397 3/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 1/20 0.34
FNTA P49354 1/20 0.32
PGGT1B P53609 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
CHRM3 P20309 2/20 0.32
AURKA O14965 1/20 0.32
NTRK1 P04629 1/20 0.32
IGF1R P08069 1/20 0.32
CDK4 P11802 1/20 0.32
EPHA1 P21709 1/20 0.32
CDK2 P24941 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
SCHEMBL4477955 1.00 ACHE (0.35) ACHEBCHEPTK2MEN1KMT2A
SCHEMBL5531271 0.75 SLC6A4 (0.38) KMT2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL2914811 0.73 CDK7 (0.35) PTK2CDK7CDK9
SCHEMBL4483776 0.72 MEN1 (0.38) ACHEPTK2MEN1KMT2APOLB
SCHEMBL4477962 0.72 MEN1 (0.38) ACHEPTK2MEN1KMT2APOLB
Hydrochloric Acid SCHEMBL2917269 0.72 TSHR (0.35) PTK2CDK7CDK9
SCHEMBL2916156 0.71 RIPK1 (0.45) F7F3
SCHEMBL2913296 0.68 RBP4 (0.36) MEN1KMT2AFNTAPGGT1BCYP1A2
SCHEMBL9294538 0.65 CHRNB2 (0.53) MEN1KMT2APOLB
SCHEMBL9294528 0.65 CHRNB2 (0.53) MEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7622585-B2 Phenylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2009-11-24 US disclosed
US-20060166997-A1 Phenylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY 2006-07-27 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 (1 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-20060166997-A1 Phenylglycinamide derivatives useful as anticoagulants TFPI, SERPINC1, SERPINE1 ACHE 1485/4885BCHE 699/4885PTK2 1732/4885

“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.