SCHEMBL2006984

SCHEMBL2006984

OCCN(CCO)c1ccc(N(c2ccc(N(CCO)CCO)cc2)c2ccc(N(c3ccc(N(CCO)CCO)cc3)c3ccc(N(CCO)CCO)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.41
MAPT P10636 5/20 0.41
MEN1 O00255 5/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
PSMD14 O00487 2/20 0.41
MITF O75030 1/20 0.41
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 1/20 0.40
ATM Q13315 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 6/20 0.38
TDP1 Q9NUW8 3/20 0.38
TSHR P16473 2/20 0.38
GAA P10253 4/20 0.37
MAPK1 P28482 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
PKM P14618 1/20 0.37
HTT P42858 1/20 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
SCHEMBL6243535 0.92 MAPT (0.44) KMT2AMAPTMEN1NPC1RAB9A
Hydrochloric Acid SCHEMBL8038931 0.89 MAPT (0.43) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL10485747 0.85 ALDH1A1 (0.54) KMT2AMAPTMEN1NPC1RAB9A
Hydrochloric Acid SCHEMBL8039735 0.83 ALDH1A1 (0.52) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL12237637 0.83 KMT2A (0.41) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL3675298 0.82 CA2 (0.42) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL8038944 0.82 ALDH1A1 (0.50) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL43229 0.81 LPL (0.40) KMT2AMAPTMEN1NPC1RAB9A
Hydrochloric Acid SCHEMBL8040784 0.80 KMT2A (0.49) KMT2AMAPTMEN1NPC1RAB9A
SCHEMBL8521178 0.80 ALDH1A1 (0.54) KMT2AMAPTMEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964754-B2 Diimmonium salt and near infrared ray absorption film containing the same SK CHEMICALS CO., LTD. (KR) 2011-06-21 US claimed
US-20100179348-A1 DIIMMONIUM SALT AND NEAR INFRARED RAY ABSORPTION FILM CONTAINING THE SAME SK CHEMICALS CO., LTD. (KR) 2010-07-15 US claimed
WO-2008030039-A1 DIIMMONIUM SALT AND NEAR INFRARED RAY ABSORPTION FILM CONTAINING THE SAME SK CHEMICALS CO., LTD. (KR) 2008-03-13 WO claimed
US-7964754-B2 Diimmonium salt and near infrared ray absorption film containing the same SK CHEMICALS CO., LTD. (KR) 2011-06-21 US disclosed
US-20100179348-A1 DIIMMONIUM SALT AND NEAR INFRARED RAY ABSORPTION FILM CONTAINING THE SAME SK CHEMICALS CO., LTD. (KR) 2010-07-15 US disclosed
WO-2008030039-A1 DIIMMONIUM SALT AND NEAR INFRARED RAY ABSORPTION FILM CONTAINING THE SAME SK CHEMICALS CO., LTD. (KR) 2008-03-13 WO 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-20100179348-A1 DIIMMONIUM SALT AND NEAR INFRARED RAY ABSORPTION FILM CONTAINING THE SAME SLC9B2, SLC9A3, SLC9A1 KMT2A 3563/4885MAPT 4609/4885MEN1 1209/4885

“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.