SCHEMBL6134745

SCHEMBL6134745

COC(=O)c1ccc(-c2nnc(-c3ccc(N4CCN(Cc5ccncc5)CC4)cc3)s2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHKA P35790 1/20 0.50
POLB P06746 1/20 0.47
TSHR P16473 3/20 0.47
MAPT P10636 2/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LSS P48449 1/20 0.47
CCR5 P51681 1/20 0.47
USP2 O75604 1/20 0.46
HDAC6 Q9UBN7 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HDAC1 Q13547 2/20 0.44
TBK1 Q9UHD2 1/20 0.44
HTT P42858 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL6134818 0.87 POLB (0.51) POLBTSHRMAPTALDH1A1SMN1; SMN2
SCHEMBL5633970 0.85 CHKA (0.56) CHKAPOLBTSHRMAPTALDH1A1
SCHEMBL6133671 0.85 MAPT (0.53) CHKAPOLBTSHRMAPTALDH1A1
SCHEMBL13244604 0.81 SMN1; SMN2 (0.65) CHKATSHRMAPTSMN1; SMN2MAPK1
SCHEMBL7339724 0.81 ALDH1A1 (0.52) TSHRMAPTALDH1A1SMN1; SMN2USP2
SCHEMBL6134965 0.81 NPC1 (0.47) POLBTSHRALDH1A1SMN1; SMN2HDAC6
SCHEMBL6376053 0.81 RAB9A (0.56) POLBTSHRMAPTALDH1A1USP2
SCHEMBL6241221 0.80 USP2 (0.46) CHKAPOLBTSHRMAPTALDH1A1
SCHEMBL6132282 0.80 PDE4D (0.46) CHKAPOLBTSHRMAPTALDH1A1
SCHEMBL6134614 0.80 DRD3 (0.47) POLBTSHRMAPTALDH1A1SMN1; SMN2

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-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 CHKA 2357/4885POLB 1754/4885TSHR 3849/4885

“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.