SCHEMBL9420532

SCHEMBL9420532

Nc1ccccc1C(=O)C(O)(COCCOCCOCCO)C(=O)c1ccccc1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 12/20 0.39
HSD17B10 Q99714 10/20 0.39
SMN1; SMN2 Q16637 5/20 0.38
HPGD P15428 3/20 0.38
TSHR P16473 3/20 0.38
TP53 P04637 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MAPK1 P28482 2/20 0.38
GLA P06280 1/20 0.38
CYP3A4 P08684 1/20 0.38
HIF1A Q16665 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CFTR P13569 1/20 0.38
KDM4E B2RXH2 6/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38

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
Hydrochloric Acid SCHEMBL9420523 0.82 APP (0.36) GAAMAPTALDH1A1HSD17B10HPGD
SCHEMBL9420497 0.80 CTSD (0.44) ALDH1A1SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL18393364 0.79 SMN1; SMN2 (0.42) GAAMAPTALDH1A1HSD17B10SMN1; SMN2
SCHEMBL9420519 0.78 LMNA (0.32) ALDH1A1SMN1; SMN2CYP3A4KDM4EKMT2A
SCHEMBL9420487 0.77 APP (0.43) GAAMAPTALDH1A1TSHRNPC1
SCHEMBL9420508 0.77 APP (0.43) GAAMAPTALDH1A1TSHRNPC1
Hydrochloric Acid SCHEMBL9420482 0.74 F2 (0.40) ALDH1A1HSD17B10SMN1; SMN2NPC1KDM4E
SCHEMBL9420490 0.73 APP (0.39) GAAMAPTALDH1A1TSHRNPC1
SCHEMBL7678490 0.71 ALDH1A1 (0.59) ALDH1A1HSD17B10SMN1; SMN2HPGDTSHR
SCHEMBL6754011 0.71 ALDH1A1 (0.41) GAAMAPTALDH1A1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12623998-B2 Process for preparing a polyisocyanate, polyisocyanate, its use and polyaddition products prepared therefrom COVESTRO DEUTSCHLAND AG (DE) 2026-05-12 US disclosed
US-20240018097-A1 PROCESS FOR PREPARING A POLYISOCYANATE, POLYISOCYANATE, ITS USE AND POLYADDITION PRODUCTS PREPARED THEREFROM COVESTRO DEUTSCHLAND AG (DE) 2024-01-18 US disclosed
EP-4259685-A1 PROCESS FOR PREPARING A POLYISOCYANATE, POLYISOCYANATE, ITS USE AND POLYADDITION PRODUCTS PREPARED THEREFROM Covestro Deutschland AG (DE) 2023-10-18 EP disclosed
CN-116568723-A Process for preparing polyisocyanates, their use and polyaddition products made therefrom 科思创德国股份有限公司 2023-08-08 CN disclosed
WO-2022122906-A1 PROCESS FOR PREPARING A POLYISOCYANATE, POLYISOCYANATE, ITS USE AND POLYADDITION PRODUCTS PREPARED THEREFROM COVESTRO DEUTSCHLAND AG (DE) 2022-06-16 WO disclosed
EP-0328585-B1 METABOLICALLY ACCEPTABLE POLYISOCYANATE ADHESIVES BIORESEARCH INC (US) 1994-09-07 EP disclosed
EP-0328585-A4 METABOLICALLY ACCEPTABLE POLYISOCYANATE ADHESIVES 1991-06-05 EP disclosed
EP-0328585-A1 METABOLICALLY ACCEPTABLE POLYISOCYANATE ADHESIVES BIORESEARCH INC. (US) 1989-08-23 EP disclosed
US-4829099-A SURGERY, POLYISOCYANATES, POLYISOTHIOCYANATES BIORESEARCH, INC. (US) 1989-05-09 US disclosed
WO-1989000589-A1 METABOLICALLY ACCEPTABLE POLYISOCYANATE ADHESIVES BIORESEARCH, INC. (US) 1989-01-26 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-12623998-B2 Process for preparing a polyisocyanate, polyisocyanate, its use and polyaddition products prepared therefrom PARG, AS3MT, PBRM1 GAA 632/4885MAPT 3834/4885ALDH1A1 1808/4885

“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.