SCHEMBL14830633

SCHEMBL14830633

O=S(=O)(Nc1ccc(F)cc1F)C1CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIT P10721 2/20 0.52
MRGPRX1 Q96LB2 6/20 0.48
TSPO P30536 2/20 0.48
TP53 P04637 1/20 0.47
THRB P10828 1/20 0.47
LMNA P02545 1/20 0.47
KMT2A Q03164 1/20 0.46
MAP2K4 P45985 1/20 0.45
HRH1 P35367 1/20 0.45
GAA P10253 1/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
ACLY P53396 1/20 0.43
NPC1 O15118 1/20 0.43
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL14830605 0.86 MRGPRX1 (0.48) KITMRGPRX1TSPOKMT2AMAP2K4
SCHEMBL12407095 0.83 MRGPRX1 (0.51) KITMRGPRX1TSPOKMT2AHRH1
SCHEMBL14830870 0.79 PSIP1 (0.53) MRGPRX1TSPOGAAPOLBSMN1; SMN2
SCHEMBL10626704 0.78 PTGS2 (0.56) KITTHRBLMNAKMT2AACLY
SCHEMBL13063815 0.77 MAP2K1 (0.54) KITMRGPRX1TSPOTP53KMT2A
SCHEMBL15847893 0.76 ACLY (0.60) MRGPRX1TSPOMAP2K4HRH1ACLY
SCHEMBL6641769 0.76 GAA (0.40) KITTP53THRBLMNAKMT2A
SCHEMBL18086455 0.76 BRAF (0.48) MRGPRX1TSPOTP53KMT2AHRH1
SCHEMBL26120220 0.75 ATM (0.46) KITMRGPRX1TSPOMAP2K4HRH1
SCHEMBL391735 0.74 KIT (0.48) KITMRGPRX1TSPOMAP2K4ACLY

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
EP-2760845-B1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER AMGEN INC (US) 2016-11-16 EP disclosed
US-9376425-B2 Heterocyclic compounds as MDM2 inhibitors for the treatment of cancer AMGEN, INC. (US) 2016-06-28 US disclosed
US-20140235629-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER AMGEN INC. 2014-08-21 US disclosed
EP-2760845-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2014-08-06 EP disclosed
WO-2013049250-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2013-04-04 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 (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-20140235629-A1 HETEROCYCLIC COMPOUNDS AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER MDM2, TP53, CDKN1A KIT 1550/4885MRGPRX1 4275/4885TSPO 4182/4885

“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.