SCHEMBL2296261

SCHEMBL2296261

CCCNC(=O)CON=C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.47
MAPT P10636 2/20 0.46
KMT2A Q03164 3/20 0.45
MEN1 O00255 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 3/20 0.44
POLB P06746 1/20 0.44
RORC P51449 1/20 0.44
LMNA P02545 3/20 0.44
GAA P10253 2/20 0.44
HTT P42858 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CNR1 P21554 1/20 0.43

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
SCHEMBL2296179 0.95 PKM (0.49) PKMMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2292597 0.93 KMT2A (0.46) PKMMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2296185 0.92 KMT2A (0.46) PKMMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2294383 0.91 PKM (0.45) PKMMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2292079 0.91 PKM (0.45) PKMMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL12419494 0.91 KMT2A (0.45) PKMMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2297221 0.90 GAA (0.49) PKMMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2296959 0.90 PKM (0.48) PKMMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2296022 0.89 KMT2A (0.45) PKMMAPTKMT2AMEN1SMN1; SMN2
SCHEMBL2294367 0.89 KMT2A (0.46) PKMMAPTKMT2AMEN1SMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230165812-A1 NOCICEPTOR NEURONS CONTROL CANCER IMMUNOSURVEILLANCE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-06-01 US disclosed
US-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2011-08-04 US disclosed
US-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2011-08-04 US disclosed
US-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2011-08-04 US disclosed
EP-2164326-A1 AMIDE COMPOUNDS AND THE USE THEREOF Euro-Celtique, S.A. (LU) 2010-03-24 EP disclosed
WO-2008150447-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2008-12-11 WO disclosed
WO-2008150447-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2008-12-11 WO 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-20230165812-A1 NOCICEPTOR NEURONS CONTROL CANCER IMMUNOSURVEILLANCE OPRL1, MRGPRX1, RAMP1 PKM 4644/4885MAPT 3141/4885KMT2A 4362/4885
US-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF CACNA1E, CACNA1B, CACNA1S PKM 1843/4885MAPT 2931/4885KMT2A 2564/4885

“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.