SCHEMBL9949255

SCHEMBL9949255

CCCCC(C)NCCCCO

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 1/20 0.42
ADRB2 P07550 8/20 0.40
DPP7 Q9UHL4 1/20 0.35
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34

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
SCHEMBL1619443 0.94 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1LMNAHSD17B10MEN1
SCHEMBL365957 0.94 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1LMNAHSD17B10MEN1
SCHEMBL1619512 0.92 LMNA (0.50) SMN1; SMN2ALDH1A1LMNAHSD17B10MEN1
Water SCHEMBL7784665 0.92 ADRB2 (0.40) SMN1; SMN2ALDH1A1LMNAHSD17B10MEN1
SCHEMBL10496376 0.90 LMNA (0.46) SMN1; SMN2ALDH1A1LMNAHSD17B10MEN1
SCHEMBL1619606 0.89 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1LMNAHSD17B10MEN1
SCHEMBL1618292 0.88 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1LMNAHSD17B10MEN1
SCHEMBL18672384 0.87 LMNA (0.45) SMN1; SMN2ALDH1A1LMNAHSD17B10MEN1
SCHEMBL7968807 0.87 ADRB2 (0.42) SMN1; SMN2ALDH1A1LMNAHSD17B10MEN1
SCHEMBL26363864 0.87 ALDH1A1 (0.43) ALDH1A1TSHRADRB2DPP7ADH1B

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-9409119-B2 Acid gas absorbent, acid gas removal method, and acid gas removal device KABUSHIKI KAISHA TOSHIBA (JP) 2016-08-09 US disclosed
EP-2705894-A1 Acid gas absorbent, acid gas removal method and acid gas removal device Kabushiki Kaisha Toshiba (JP) 2014-03-12 EP disclosed
US-20120161071-A1 ACID GAS ABSORBENT, ACID GAS REMOVAL METHOD, AND ACID GAS REMOVAL DEVICE KABUSHIKI KAISHA TOSHIBA (JP) 2012-06-28 US disclosed
EP-2468385-A2 Acid gas absorbent, acid gas removal method and acid gas removal device Kabushiki Kaisha Toshiba (JP) 2012-06-27 EP 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-20120161071-A1 ACID GAS ABSORBENT, ACID GAS REMOVAL METHOD, AND ACID GAS REMOVAL DEVICE ALKBH1, ALKBH3, ALKBH2 SMN1; SMN2 3228/4885ALDH1A1 247/4885LMNA 4049/4885

“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.