SCHEMBL19852738

SCHEMBL19852738

CC1(NC(N)=S)CCCCCCCCC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.33
CTSK P43235 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
SCHEMBL19852722 1.00 ALDH1A1 (0.46) ALDH1A1LMNASMN1; SMN2POLBGAA
SCHEMBL28847750 1.00 ALDH1A1 (0.46) ALDH1A1LMNASMN1; SMN2POLBGAA
SCHEMBL17150980 0.98 ALDH1A1 (0.42) ALDH1A1LMNASMN1; SMN2POLBGAA
SCHEMBL25878264 0.87
Zinc Ion SCHEMBL2923807 0.79 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2
SCHEMBL13374694 0.76 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2
SCHEMBL11737698 0.76 ALDH1A1 (0.47) ALDH1A1LMNASMN1; SMN2POLB
Zinc Ion SCHEMBL18786899 0.74 ALDH1A1 (0.32) ALDH1A1LMNAPOLB
SCHEMBL11733763 0.73 ALDH1A1 (0.44) ALDH1A1LMNASMN1; SMN2POLB
SCHEMBL11301997 0.73 NOS1 (0.42) ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180037556-A1 COMPOUNDS AND METHODS FOR INDUCING BROWNING OF WHITE ADIPOSE TISSUE BEIJING ERAI THERAPEUTICS CO., LTD. (CN) 2018-02-08 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-20180037556-A1 COMPOUNDS AND METHODS FOR INDUCING BROWNING OF WHITE ADIPOSE TISSUE FABP4, LRBA, GPR119 ALDH1A1 181/4885LMNA 2845/4885SMN1; SMN2 4486/4885

“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.