SCHEMBL4874554

SCHEMBL4874554

S=C(Nc1ccc(Cl)cc1)N1CCc2ccccc2CC1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.69
LMNA P02545 5/20 0.68
KMT2A Q03164 5/20 0.63
MEN1 O00255 4/20 0.63
GAA P10253 1/20 0.63
HPGD P15428 1/20 0.59
NPSR1 Q6W5P4 1/20 0.58
ALDH1A1 P00352 3/20 0.56
MAPT P10636 1/20 0.56
HTT P42858 1/20 0.55
GLA P06280 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C19 P33261 1/20 0.53
TAAR1 Q96RJ0 1/20 0.52
TAS1R3 Q7RTX0 1/20 0.51
TAS1R1 Q7RTX1 1/20 0.51
TAS1R2 Q8TE23 1/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL4882042 0.84 TAS1R3 (0.67) SMN1; SMN2LMNAKMT2AMEN1GAA
SCHEMBL14119932 0.81 LMNA (1.00) SMN1; SMN2LMNAKMT2AMEN1GAA
SCHEMBL4883085 0.80 IDO1 (0.64) SMN1; SMN2LMNANPSR1ALDH1A1HTT
SCHEMBL4883090 0.80 IDO1 (0.64) SMN1; SMN2LMNANPSR1ALDH1A1HTT
SCHEMBL13720129 0.79 SMN1; SMN2 (0.72) SMN1; SMN2LMNAKMT2AMEN1GAA
SCHEMBL4877647 0.76 SMN1; SMN2 (0.71) SMN1; SMN2LMNAKMT2AMEN1GAA
SCHEMBL14119792 0.74 ALDH1A1 (0.82) LMNAKMT2AMEN1GAANPSR1
SCHEMBL316042 0.73 SMN1; SMN2 (0.74) SMN1; SMN2LMNAKMT2AMEN1GAA
SCHEMBL5708822 0.73 KMT2A (0.81) SMN1; SMN2LMNAKMT2AMEN1GAA
SCHEMBL15919893 0.73 NPY2R (0.76) SMN1; SMN2LMNAKMT2AMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080234252-A1 Compounds Useful in Therapy PFIZER INC 2008-09-25 US disclosed
US-20080234252-A1 Compounds Useful in Therapy PFIZER INC 2008-09-25 US disclosed
US-20080234252-A1 Compounds Useful in Therapy PFIZER INC 2008-09-25 US disclosed
WO-2006123242-A1 1, 2, 4 -TRIAZOLE DERIVATIVES AS VASOPRESSIN ANTAGONISTS PFIZER LIMITED (GB) 2006-11-23 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-20080234252-A1 Compounds Useful in Therapy AVPR1A, AVPR1B, AVPR2 SMN1; SMN2 2757/4885LMNA 1476/4885KMT2A 2146/4885

“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.