SCHEMBL14830771

SCHEMBL14830771

CC(C)(C)S(=O)(=O)Nc1ccccc1F

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.59
SLC22A12 Q96S37 1/20 0.54
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
CA2 P00918 2/20 0.46
PKM P14618 1/20 0.46
PDK1 Q15118 1/20 0.44
PDK2 Q15119 1/20 0.44
PDK3 Q15120 1/20 0.44
PDK4 Q16654 1/20 0.44
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
KDM4E B2RXH2 2/20 0.41
PTGES2 Q9H7Z7 1/20 0.41
ALOX12 P18054 1/20 0.41
TSHR P16473 1/20 0.41
CA1 P00915 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
SCHEMBL20489994 0.84 PSIP1 (0.58) PSIP1SLC22A12ALDH1A1SMN1; SMN2POLB
SCHEMBL10622905 0.82 CA2 (0.61) PSIP1SLC22A12SMN1; SMN2CA2RAB9A
SCHEMBL12932924 0.78 ALDH1A1 (0.50) ALDH1A1POLBCA2RAB9ANPC1
SCHEMBL12601590 0.78 LMNA (0.51) GAAMAPTCA2TSHRCA1
SCHEMBL20489992 0.78 CA2 (0.51) PSIP1SLC22A12SMN1; SMN2CA2RAB9A
SCHEMBL20290538 0.78 KMT2A (0.55) SLC22A12ALDH1A1SMN1; SMN2POLBGAA
SCHEMBL6897963 0.78 PSIP1 (0.66) PSIP1SLC22A12ALDH1A1SMN1; SMN2POLB
SCHEMBL13565626 0.77 PSIP1 (0.44) PSIP1SLC22A12ALDH1A1GAACA2
SCHEMBL5849242 0.77 CA2 (0.46) POLBCA2PDK1PDK2PDK3
SCHEMBL10116197 0.76 RAB9A (0.56) ALDH1A1SMN1; SMN2MAPTCA2RAB9A

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 PSIP1 3547/4885SLC22A12 2757/4885ALDH1A1 553/4885

“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.