SCHEMBL1453640

SCHEMBL1453640

CC1=Cc2ccccc2C1CC1C(C)=Cc2c(-c3cccs3)cccc21

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.36
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HTR1A P08908 2/20 0.30
HTR7 P34969 2/20 0.30
PTAFR P25105 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
KEAP1 Q14145 1/20 0.30

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
SCHEMBL1452795 0.93 LTA4H (0.36) LTA4HRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL1453476 0.85 LTA4H (0.33) LTA4HRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL1454411 0.80 PDCD1 (0.34) SMN1; SMN2MAPK1TDP1KDM4E
SCHEMBL1453194 0.79 RAB9A (0.33) LTA4HRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL1452577 0.79 RAB9A (0.37) LTA4HRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL1452236 0.79 CYP11B1 (0.31)
SCHEMBL1452923 0.78 LTA4H (0.33) LTA4HRAB9ASMN1; SMN2NPC1MAPK1
SCHEMBL1453851 0.77 TACR1 (0.31)
SCHEMBL1452870 0.76 HTR2A (0.42) SMN1; SMN2TDP1ALDH1A1KDM4E
SCHEMBL1452155 0.75 ALDH1A1 (0.33) NPC1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7910783-B2 Preparation of substituted bridged indenyl and related ligands EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-03-22 US disclosed
US-20070135596-A1 Preparation of substituted bridged indenyl and related ligands EXXONMOBIL CHEMICAL PATENTS INC. 2007-06-14 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-20070135596-A1 Preparation of substituted bridged indenyl and related ligands SP1, TTL, TTLL12 LTA4H 4290/4885RAB9A 3323/4885SMN1; SMN2 4340/4885

“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.