SCHEMBL9950238

SCHEMBL9950238

CCCCC(CC)NCCCO

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
CNR1 P21554 1/20 0.46
ADRA1A P35348 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KDM4E B2RXH2 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
ABCC3 O15438 1/20 0.45
ALDH1A1 P00352 4/20 0.40
TSHR P16473 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP3A4 P08684 1/20 0.34
CA2 P00918 5/20 0.34
CA1 P00915 4/20 0.34
MAPK1 P28482 1/20 0.33

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
SCHEMBL9949435 0.94 LMNA (0.45) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL1619918 0.94 LMNA (0.45) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL1618085 0.92 LMNA (0.44) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL117119 0.92 LMNA (0.44) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL9949550 0.91 ALDH1A1 (0.43) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL9950009 0.89 LMNA (0.48) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL2194365 0.89 LMNA (0.48) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL1619618 0.88 SMN1; SMN2 (0.46) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL9950040 0.88 ALDH1A1 (0.40) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL1619615 0.86 LMNA (0.48) LMNACNR1ADRA1ATDP1KDM4E

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 LMNA 4049/4885CNR1 355/4885ADRA1A 577/4885

“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.