SCHEMBL124499

SCHEMBL124499

CCN1C(=O)CC(=O)N(CC(F)(F)F)C1=S

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.33
F2 P00734 1/20 0.32
ELANE P08246 1/20 0.32
CTSG P08311 1/20 0.32
CTRC Q99895 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
TNFRSF1A P19438 2/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL1033205 0.84 F2 (0.43) SMN1; SMN2F2ELANECTSGCTRC
SCHEMBL124495 0.81 F2 (0.44) SMN1; SMN2F2ELANECTSGCTRC
SCHEMBL12194191 0.75 F2 (0.39) SMN1; SMN2F2ELANECTSGCTRC
SCHEMBL6374912 0.73 F2 (0.37) SMN1; SMN2F2ELANECTSGCTRC
SCHEMBL10646550 0.71
SCHEMBL6162730 0.69 MAPT (0.35) SMN1; SMN2MEN1KMT2ATNFRSF1ANPC1
SCHEMBL141302 0.67 F2 (0.63) SMN1; SMN2F2ELANECTSGCTRC
SCHEMBL8083943 0.66 ALDH1A1 (0.39) MEN1KMT2AALDH1A1LMNAPOLB
SCHEMBL145408 0.66 KDM4E (0.46) SMN1; SMN2MEN1KMT2ANPC1ALDH1A1
SCHEMBL3831786 0.65 F2 (0.60) SMN1; SMN2F2ELANECTSGCTRC

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-20120059163-A1 Non-linear opticaly active molecules, their synthesis, and use OPTIMER PHOTONICS, INC. (US) 2012-03-08 US disclosed
US-20080004415-A1 Non-linear optically active molecules, their synthesis, and use OPTIMER PHOTONICS, INC. (US) 2008-01-03 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-20120059163-A1 Non-linear opticaly active molecules, their synthesis, and use INCENP, CYBA, ADCY5 SMN1; SMN2 4522/4885F2 705/4885ELANE 3816/4885
US-20080004415-A1 Non-linear optically active molecules, their synthesis, and use INCENP, CYBA, PAICS SMN1; SMN2 4430/4885F2 723/4885ELANE 3465/4885

“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.