SCHEMBL16985198

SCHEMBL16985198

CCN(CCCC(=O)OC)c1cc(OC)ccc1C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
CRHR1 P34998 1/20 0.39
HTT P42858 5/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 3/20 0.39
HSD17B10 Q99714 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DYRK1A Q13627 3/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
LTA4H P09960 1/20 0.38
PPARG P37231 1/20 0.37
MTNR1A P48039 2/20 0.37
MTNR1B P49286 2/20 0.37

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
SCHEMBL16985197 0.91 TSHR (0.45) ALDH1A1CRHR1HTTLMNAMAPT
SCHEMBL17030789 0.88 PDE3B (0.40) ALDH1A1HTTLMNAMAPTHSD17B10
SCHEMBL14013331 0.86 LTA4H (0.40) ALDH1A1HTTLMNAMAPTHSD17B10
SCHEMBL16986013 0.80 ALDH1A1 (0.34) ALDH1A1CRHR1HTTLMNAMAPT
SCHEMBL2502826 0.80 TSHR (0.44) ALDH1A1HTTLMNAMAPTSMN1; SMN2
SCHEMBL4275474 0.79 TSHR (0.43) ALDH1A1HTTLMNAMAPTKMT2A
SCHEMBL11310244 0.79 CRHR1 (0.42) ALDH1A1CRHR1HTTLMNAMAPT
SCHEMBL14038445 0.78 THRA (0.47) ALDH1A1MAPTKMT2AMEN1LTA4H
SCHEMBL14882515 0.77 TDP1 (0.43) ALDH1A1HTTMAPTHSD17B10KMT2A
SCHEMBL2502597 0.76 NLRP3 (0.43) ALDH1A1MAPTHSD17B10SMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170145214-A1 FLUOROGENIC PH-SENSITIVE DYES AND THEIR METHODS OF USE (II) Life Technologies Corporation 2017-05-25 US disclosed
US-9599622-B2 Fluorogenic pH-sensitive dyes and their methods of use (II) Life Technologies Corporation (US) 2017-03-21 US disclosed
US-20150241438-A1 Fluorogenic pH-Sensitive Dyes and Their Methods of Use Life Technologies Corporation 2015-08-27 US disclosed
US-20150218379-A1 Fluorogenic pH-Sensitive Dyes and Their Methods of Use (II) Life Technologies Corporation 2015-08-06 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-20150241438-A1 Fluorogenic pH-Sensitive Dyes and Their Methods of Use ALPG, XDH, HEXD ALDH1A1 960/4885CRHR1 4463/4885HTT 2849/4885

“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.