SCHEMBL5747448

SCHEMBL5747448

Cc1ccc(C)c(-c2cc3cnccc3nc2NC(=O)NC2CCCCC2)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
EPHX1 P07099 3/20 0.45
POLB P06746 1/20 0.44
GAA P10253 1/20 0.43
HTT P42858 2/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
EPHX2 P34913 1/20 0.43
AAK1 Q2M2I8 1/20 0.42
LCK P06239 1/20 0.41
CSF1R P07333 1/20 0.41
KDR P35968 1/20 0.41
MAPK14 Q16539 1/20 0.41
PRMT3 O60678 1/20 0.41
CHRM4 P08173 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL5746318 0.86 LCK (0.36) RAB9ASMN1; SMN2LCKCSF1RKDR
SCHEMBL5747463 0.86 EPHX1 (0.46) NPC1RAB9AEPHX1POLBGAA
SCHEMBL5748571 0.85 NPC1 (0.51) NPC1RAB9AEPHX1POLBGAA
SCHEMBL5749111 0.83 ABL1 (0.43) NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL5749355 0.81 LMNA (0.49) NPC1RAB9AEPHX1POLBSMN1; SMN2
SCHEMBL5749919 0.81 FGFR1 (0.48) SMN1; SMN2KDR
SCHEMBL5747433 0.81 FGFR1 (0.47) SMN1; SMN2KDRKMT2A
SCHEMBL5748810 0.78 NPC1 (0.50) NPC1RAB9AEPHX1POLBGAA
SCHEMBL5750018 0.78 POLB (0.47) NPC1RAB9AEPHX1POLBGAA
SCHEMBL5750702 0.78 GAA (0.43) NPC1RAB9AEPHX1POLBGAA

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
EP-1372648-B1 TIE2 RECEPTOR KINASE INHIBITORS FOR TREATING ANGIOGENIC DISEASES SMITHKLINE BEECHAM CORP (US) 2006-03-15 EP disclosed
US-7005434-B2 Compounds and uses thereof SB CORPORATION (US) 2006-02-28 US disclosed
US-20040048888-A1 Novel compounds and uses thereof SMITHKLINE BEECHAM CORPORATION 2004-03-11 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-20040048888-A1 Novel compounds and uses thereof TEK, TIE1, KDR NPC1 2798/4885RAB9A 2298/4885EPHX1 628/4885

“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.