SCHEMBL2560028

SCHEMBL2560028

Cc1cnc(Cl)nc1N1CCC(C(N)=O)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.51
KDM4E B2RXH2 3/20 0.51
TDP1 Q9NUW8 2/20 0.51
ALDH1A1 P00352 2/20 0.51
HCRTR2 O43614 1/20 0.48
LMNA P02545 2/20 0.45
TP53 P04637 1/20 0.45
RECQL P46063 1/20 0.44
AKT2 P31751 1/20 0.44
NEK2 P51955 1/20 0.44
TSHR P16473 1/20 0.43
ALOX12 P18054 1/20 0.42
CYP2C19 P33261 1/20 0.42
ABL1 P00519 1/20 0.42
POLB P06746 2/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 1/20 0.40
TDP2 O95551 1/20 0.40

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
SCHEMBL1939014 0.84 ABL1 (0.53) CYP3A4KDM4ETDP1ALDH1A1RECQL
SCHEMBL22860796 0.82 MAPT (0.60) KDM4EALDH1A1HCRTR2LMNATP53
SCHEMBL1400767 0.81 HCRTR2 (0.47) KDM4EALDH1A1HCRTR2LMNAABL1
SCHEMBL1938711 0.79 TSHR (0.55) CYP3A4KDM4ETDP1ALDH1A1LMNA
SCHEMBL2555821 0.78 CYP3A4 (0.51) CYP3A4KDM4ETDP1ALDH1A1HCRTR2
SCHEMBL3436551 0.78 CYP3A4 (0.51) CYP3A4KDM4ETDP1ALDH1A1LMNA
SCHEMBL1939348 0.78 AKT2 (0.52) CYP3A4KDM4ETDP1ALDH1A1LMNA
SCHEMBL21815409 0.76 ABL1 (0.46) HCRTR2ABL1SMN1; SMN2MEN1KMT2A
SCHEMBL3436564 0.76 CYP3A4 (0.51) CYP3A4KDM4ETDP1ALDH1A1LMNA
SCHEMBL3436555 0.75 ALDH1A1 (0.53) CYP3A4KDM4ETDP1ALDH1A1LMNA

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
US-20130096160-A1 ARYLTHIAZOLYL PIPERIDINES AND RELATED COMPOUNDS AS MODULATORS OF SURVIVAL MOTOR NEURON (SMN) PROTEIN PRODUCTION SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2013-04-18 US disclosed
US-20130096160-A1 ARYLTHIAZOLYL PIPERIDINES AND RELATED COMPOUNDS AS MODULATORS OF SURVIVAL MOTOR NEURON (SMN) PROTEIN PRODUCTION SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2013-04-18 US disclosed
US-20130096160-A1 ARYLTHIAZOLYL PIPERIDINES AND RELATED COMPOUNDS AS MODULATORS OF SURVIVAL MOTOR NEURON (SMN) PROTEIN PRODUCTION SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2013-04-18 US disclosed
WO-2011130515-A1 ARYLTHIAZOLYL PIPERIDINES AND RELATED COMPOUNDS AS MODULATORS OF SURVIVAL MOTOR NEURON (SMN) PROTEIN PRODUCTION THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-10-20 WO disclosed
WO-2011130515-A1 ARYLTHIAZOLYL PIPERIDINES AND RELATED COMPOUNDS AS MODULATORS OF SURVIVAL MOTOR NEURON (SMN) PROTEIN PRODUCTION THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-10-20 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-20130096160-A1 ARYLTHIAZOLYL PIPERIDINES AND RELATED COMPOUNDS AS MODULATORS OF SURVIVAL MOTOR NEURON (SMN) PROTEIN PRODUCTION SMN1; SMN2, MTPN, MORF4L1 CYP3A4 4772/4885KDM4E 1874/4885TDP1 914/4885

“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.