SCHEMBL12772003

SCHEMBL12772003

CN(C)Cc1ccccc1P(Cl)Cl

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 15/20 0.44
SLC6A2 P23975 13/20 0.44
SLC6A3 Q01959 12/20 0.44
HTR2A P28223 3/20 0.42
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
LMNA P02545 1/20 0.41
KCNH2 Q12809 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL12772036 0.81 TAAR1 (0.39) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL12771994 0.80 TSHR (0.45) ALDH1A1TSHRLMNAKDM4EMEN1
SCHEMBL125255 0.77 ALDH1A1 (0.57) SLC6A4SLC6A2SLC6A3HTR2AALDH1A1
SCHEMBL29729780 0.77 ALDH1A1 (0.57) SLC6A4SLC6A2SLC6A3HTR2AALDH1A1
SCHEMBL12772013 0.76 TAAR1 (0.36) KCNH2
SCHEMBL12772004 0.76 SLC6A4 (0.47) SLC6A4SLC6A2SLC6A3HTR2AALDH1A1
SCHEMBL3665712 0.76 SLC6A4 (0.44) SLC6A4SLC6A2SLC6A3HTR2AALDH1A1
SCHEMBL28530344 0.76 GABRA1 (0.41) LMNACYP2D6
SCHEMBL12772009 0.75 CNR2 (0.41) ALDH1A1TSHRKDM4E
SCHEMBL12772001 0.75 SLC6A4 (0.45) SLC6A4SLC6A2SLC6A3ALDH1A1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7915455-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-29 US disclosed
US-7915455-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-03-29 US disclosed
EP-2272852-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex Sumitomo Chemical Company, Limited (JP) 2011-01-12 EP disclosed
US-20090143620-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED 2009-06-04 US disclosed
US-7482414-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-27 US disclosed
US-7482414-B2 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-27 US disclosed
US-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-14 US disclosed
US-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 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 (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-20070135600-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex AP1M1, OR10J3, AP2M1 SLC6A4 3977/4885SLC6A2 4283/4885SLC6A3 2573/4885
US-20090143620-A1 Transition metal complex ligand and olefin polymerization catalyst containing transition metal complex AP1M1, OR10J3, AP2M1 SLC6A4 3977/4885SLC6A2 4283/4885SLC6A3 2573/4885

“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.