SCHEMBL5951974

SCHEMBL5951974

CCCC[Sn](CCCC)(CCCC)c1ccc(C)cc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TP53 P04637 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
TLR8 Q9NR97 3/20 0.33
KDM4E B2RXH2 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 2/20 0.31
NPC1 O15118 1/20 0.31
GPX4 P36969 1/20 0.31
RAB9A P51151 1/20 0.31
PAX8 Q06710 1/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SKP2 Q13309 1/20 0.31
CNR1 P21554 1/20 0.31

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
SCHEMBL1453413 0.85 TLR8 (0.36) MAPTHTTTSHRTP53TDP1
SCHEMBL5721726 0.81 NFE2L2 (0.34) MAPTHTTTP53TLR8KDM4E
SCHEMBL13584663 0.76 PTGS2 (0.38)
SCHEMBL1453183 0.76 TSHR (0.36) MAPTHTTTSHRTP53TLR8
SCHEMBL2481986 0.74 HPGD (0.33) HTTTSHRKDM4ESMN1; SMN2NPC1
SCHEMBL15529503 0.73 ALDH1A1 (0.34) MAPTHTTTSHRTP53TDP1
SCHEMBL1452840 0.71 HTT (0.38) HTTTSHRTDP1SMN1; SMN2ALDH1A1
SCHEMBL14634134 0.71
SCHEMBL6729852 0.70 L3MBTL1 (0.36) TDP1L3MBTL1
SCHEMBL14797277 0.70 TLR8 (0.35) TLR8SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7038070-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2006-05-02 US disclosed
US-6963017-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2005-11-08 US disclosed
EP-0968158-B1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM BASELL POLYOLEFINE GMBH (DE) 2005-08-10 EP disclosed
US-20050033076-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2005-02-10 US disclosed
US-20030009046-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2003-01-09 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 (2 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-20050033076-A1 Preparation of preparing substituted indanones CYP1A2, CYP2J2, IDH3A MAPT 3693/4885HTT 4095/4885TSHR 4624/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 MAPT 3748/4885HTT 4113/4885TSHR 4667/4885

“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.