SCHEMBL14859271

SCHEMBL14859271

O=C(O)NC1CCN(c2nc(-c3ccc(Br)cc3)cs2)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 13/20 0.68
RAB9A P51151 8/20 0.68
NPC1 O15118 6/20 0.68
MEN1 O00255 5/20 0.68
KMT2A Q03164 5/20 0.68
MAPT P10636 5/20 0.57
CYP1A2 P05177 2/20 0.57
CYP2C9 P11712 2/20 0.57
CYP2C19 P33261 2/20 0.57
HPGD P15428 1/20 0.57
MAPK1 P28482 2/20 0.57
LMNA P02545 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.53
ESR1 P03372 1/20 0.53
HTT P42858 1/20 0.53
ALDH1A1 P00352 2/20 0.49
CYP2D6 P10635 1/20 0.49
AR P10275 1/20 0.46
TP53 P04637 1/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL2553847 0.90 SMN1; SMN2 (0.67) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL2557611 0.84 SMN1; SMN2 (0.80) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL12291659 0.84 SMN1; SMN2 (0.60) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL2558665 0.81 SMN1; SMN2 (0.43) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL2557908 0.81 SMN1; SMN2 (1.00) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL2555791 0.81 SMN1; SMN2 (0.73) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL2557852 0.79 SMN1; SMN2 (0.68) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL2555926 0.79 SMN1; SMN2 (0.71) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL2558696 0.78 SMN1; SMN2 (0.73) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL2558955 0.78 SMN1; SMN2 (0.69) SMN1; SMN2RAB9ANPC1MEN1KMT2A

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 1 patent. 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

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 SMN1; SMN2 1/4885RAB9A 1682/4885NPC1 2811/4885

“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.