SCHEMBL14830870

SCHEMBL14830870

O=S(=O)(Nc1ccccc1F)C1CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.53
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
ALOX5AP P20292 2/20 0.46
FEN1 P39748 2/20 0.46
SLC22A12 Q96S37 1/20 0.45
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MRGPRX1 Q96LB2 10/20 0.43
TSPO P30536 1/20 0.43
CKS1B P61024 1/20 0.43
SKP2 Q13309 1/20 0.43
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL29781374 0.84 PSIP1 (0.49) PSIP1ALOX5APFEN1SLC22A12TSHR
SCHEMBL14831080 0.81 SCN9A (0.43) PTGS1PTGS2ALOX5APFEN1SMN1; SMN2
SCHEMBL14830605 0.79 MRGPRX1 (0.48) TSHRMRGPRX1TSPOPOLB
SCHEMBL14830633 0.79 KIT (0.52) SMN1; SMN2MRGPRX1TSPOPOLBGAA
SCHEMBL29739977 0.78 PTGS1 (0.47) PTGS1PTGS2ALOX5APFEN1MRGPRX1
SCHEMBL10270716 0.78 ALDH1A1 (0.47) PTGS1PTGS2TSHRMRGPRX1CKS1B
SCHEMBL22290162 0.78 PTGS1 (0.47) PTGS1PTGS2ALOX5APFEN1MRGPRX1
SCHEMBL14830962 0.78 TSHR (0.47) PTGS1PTGS2TSHRMRGPRX1CKS1B
SCHEMBL6897963 0.76 PSIP1 (0.66) PSIP1SLC22A12SMN1; SMN2POLBGAA
SCHEMBL12407095 0.76 MRGPRX1 (0.51) ALOX5APFEN1MRGPRX1TSPO

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 9 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
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-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
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
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 PSIP1 3547/4885PTGS1 1366/4885PTGS2 1675/4885

“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.