SCHEMBL17359140

SCHEMBL17359140

CN(C)CCCCC(C(=O)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
KDM4A O75164 12/20 0.41
KDM4C Q9H3R0 12/20 0.41
KDM5A P29375 1/20 0.41
KDM7A Q6ZMT4 1/20 0.41
PHF8 Q9UPP1 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
DNM1 Q05193 3/20 0.39
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38

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
SCHEMBL28027517 0.98 ALDH1A1 (0.43) ALDH1A1TSHRKDM4AKDM4CKDM5A
SCHEMBL15710764 0.93 HTR2A (0.43) ALDH1A1TSHRKDM4AKDM4CKDM5A
SCHEMBL15711311 0.91 HTR2A (0.42) ALDH1A1TSHRKDM4AKDM4CKDM5A
SCHEMBL2333725 0.82 HTR2A (0.39) ALDH1A1TSHRKDM4AKDM4CHTR2A
SCHEMBL25468996 0.82 LTA4H (0.50) ALDH1A1TSHRKDM4AKDM4CKDM5A
SCHEMBL8062393 0.82 LTA4H (0.50) ALDH1A1TSHRKDM4AKDM4CKDM5A
SCHEMBL11226698 0.80 ALDH1A1 (0.40) ALDH1A1TSHRKDM4AKDM4CKDM5A
SCHEMBL881063 0.80 NOS2 (0.58) TSHR
SCHEMBL19198715 0.80 NOS3 (0.33) ALDH1A1KDM4AKDM4CPHF8KDM2A
SCHEMBL14610975 0.80 ACE2 (0.50) ALDH1A1TSHRKDM4AKDM4CKDM5A

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-9725477-B2 Platinum compounds of malonic acid derivative having leaving group containing amino or alkylamino BEIJING FSWELCOME TECHNOLOGY DEVELOPMENT CO., LTD (CN) 2017-08-08 US disclosed
US-20150368281-A1 Platinum Compounds Of Malonic Acid Derivative Having Leaving Group Containing Amino Or Alkylamino BEIJING FSWELCOME TECHNOLOGY DEVELOPMENT CO., LTD (CN) 2015-12-24 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-20150368281-A1 Platinum Compounds Of Malonic Acid Derivative Having Leaving Group Containing Amino Or Alkylamino SLC7A1, ME3, SLC7A5 ALDH1A1 246/4885TSHR 4501/4885KDM4A 3454/4885

“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.