SCHEMBL2553916

SCHEMBL2553916

O=C(c1ccccc1)N1CCN(c2nc(-c3ccc(Br)cc3)cs2)CC1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 10/20 0.74
MAPT P10636 9/20 0.74
ALDH1A1 P00352 6/20 0.74
MAPK1 P28482 6/20 0.74
LMNA P02545 3/20 0.74
MEN1 O00255 6/20 0.61
KMT2A Q03164 6/20 0.61
RAB9A P51151 7/20 0.60
NPC1 O15118 5/20 0.60
TDP1 Q9NUW8 2/20 0.59
ATM Q13315 1/20 0.59
HSD17B10 Q99714 1/20 0.58
CYP1A2 P05177 3/20 0.55
CYP2C19 P33261 3/20 0.55
CYP2C9 P11712 2/20 0.55
CYP2D6 P10635 1/20 0.55
HPGD P15428 1/20 0.55
RECQL P46063 1/20 0.53
HTT P42858 2/20 0.53
USP2 O75604 2/20 0.53

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
SCHEMBL2559492 0.83 SMN1; SMN2 (0.65) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL2557601 0.83 SMN1; SMN2 (0.70) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL2556930 0.82 MAPT (0.81) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL3761593 0.80 RAB9A (0.74) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL12290020 0.78 SMN1; SMN2 (0.65) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL11064658 0.78 RAB9A (0.71) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL18674602 0.78 RAB9A (0.75) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL2557611 0.77 SMN1; SMN2 (0.80) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL2557151 0.77 SMN1; SMN2 (0.69) SMN1; SMN2MAPTALDH1A1MAPK1LMNA
SCHEMBL27669237 0.77 RAB9A (0.59) SMN1; SMN2MAPTALDH1A1MAPK1LMNA

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 7 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 claimed
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 claimed
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 SMN1; SMN2 1/4885MAPT 203/4885ALDH1A1 1296/4885

“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.