SCHEMBL5657891

SCHEMBL5657891

Cn1cnnc1SCCSc1ccc(N)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
GAA P10253 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TP53 P04637 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 7/20 0.43
KDM4E B2RXH2 4/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
MAPT P10636 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CRBN Q96SW2 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL5657754 0.80 GCK (0.46) ALDH1A1KDM4ECYP3A4
SCHEMBL5654082 0.79 ALDH1A1 (0.53) LMNAGAAMEN1KMT2ATP53
SCHEMBL5655743 0.75 KDM4E (0.47) GAAMEN1KMT2ATP53SMN1; SMN2
SCHEMBL24866724 0.74 LMNA (0.53) LMNAGAAMEN1KMT2ATP53
SCHEMBL1808815 0.73 CYP3A4 (0.55) GAAMEN1KMT2ATP53ALDH1A1
SCHEMBL14969208 0.71 ALDH1A1 (0.53) LMNAGAAMEN1KMT2ATP53
SCHEMBL5657503 0.71 MEN1 (0.49) GAAMEN1KMT2ATP53SMN1; SMN2
SCHEMBL11953074 0.71 ALDH1A1 (0.50) LMNAGAAMEN1KMT2ATP53
SCHEMBL4378220 0.70 ALDH1A1 (0.49) LMNAGAAMEN1KMT2ATP53
SCHEMBL5655790 0.70 MEN1 (0.36) GAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262185-B2 Benzazepine derivative, process for producing the same, and use TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 2007-08-28 US disclosed
US-20040235822-A1 Benzazepine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-11-25 US disclosed
EP-1422228-A1 BENZAZEPINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Chemical Industries, Ltd. (JP) 2004-05-26 EP 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-20040235822-A1 Benzazepine derivative, process for producing the same, and use CYP1B1, CYP1A1, CYP2E1 LMNA 753/4885GAA 2987/4885MEN1 729/4885

“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.