SCHEMBL7528767

SCHEMBL7528767

Clc1cccc(-c2ccc(OCc3ccccc3)cc2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 4/20 0.55
RAB9A P51151 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MEN1 O00255 1/20 0.54
NPC1 O15118 1/20 0.54
POLB P06746 1/20 0.54
KMT2A Q03164 1/20 0.54
ENPP3 O14638 1/20 0.53
ENPP1 P22413 1/20 0.53
MCL1 Q07820 3/20 0.51
XDH P47989 1/20 0.51
WDR5 P61964 1/20 0.49
GSTP1 P09211 1/20 0.49
MAOB P27338 2/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
PTGS1 P23219 1/20 0.49
SLC6A2 P23975 1/20 0.49
CYP2C19 P33261 1/20 0.49
PTGS2 P35354 1/20 0.49

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
SCHEMBL31086460 0.81 PRMT5 (0.53) PRMT5RAB9ASMN1; SMN2MEN1NPC1
SCHEMBL29254767 0.81 PRMT5 (0.53) PRMT5RAB9ASMN1; SMN2MEN1NPC1
SCHEMBL7373015 0.79 MCL1 (0.55) PRMT5RAB9ASMN1; SMN2MEN1NPC1
SCHEMBL8615437 0.79 RAB9A (0.57) PRMT5RAB9ASMN1; SMN2MEN1NPC1
SCHEMBL8614763 0.79 RAB9A (0.54) PRMT5RAB9ASMN1; SMN2MEN1NPC1
SCHEMBL27743534 0.78 CYP1A2 (0.61) PRMT5RAB9ASMN1; SMN2MEN1NPC1
SCHEMBL6587114 0.77 ENPP3 (0.55) PRMT5RAB9ASMN1; SMN2MEN1NPC1
SCHEMBL7379345 0.77 PRMT5 (0.59) PRMT5RAB9ASMN1; SMN2MEN1NPC1
SCHEMBL8616299 0.76 LMNA (0.53) PRMT5RAB9ASMN1; SMN2MEN1NPC1
SCHEMBL197017 0.76 LMNA (0.72) RAB9ASMN1; SMN2MEN1NPC1POLB

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-20020099210-A1 Propanoic acid derivatives as integrin inhibitors CELLTECH CHIROSCIENCE LTD. (GB) 2002-07-25 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-20020099210-A1 Propanoic acid derivatives as integrin inhibitors ITGA1, ITGB1, ITGB7 PRMT5 3940/4885RAB9A 1587/4885SMN1; SMN2 4162/4885

“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.