SCHEMBL29935786

SCHEMBL29935786

Cn1ncc2cc(C=O)cnc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.40
ALDH1A1 P00352 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
APP P05067 1/20 0.38
NAMPT P43490 1/20 0.38
CYP2A6 P11509 2/20 0.35
CACNA1H O95180 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
PI4KA P42356 1/20 0.33
PI4K2B Q8TCG2 1/20 0.33
PI4K2A Q9BTU6 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
ALOX15 P16050 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP11B2 P19099 1/20 0.32
MAOB P27338 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31

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
SCHEMBL24345675 1.00 PTGER4 (0.40) PTGER4ALDH1A1RXFP1APPNAMPT
SCHEMBL13837838 0.82 APP (0.38) ALDH1A1APPNAMPTCACNA1HMEN1
SCHEMBL6952609 0.74 CYP2A6 (0.53) PTGER4ALDH1A1APPCYP2A6CACNA1H
SCHEMBL29935942 0.74 CYP2A6 (0.53) PTGER4ALDH1A1APPCYP2A6CACNA1H
SCHEMBL7920028 0.73 CCR1 (0.43) ALDH1A1APPNAMPTCACNA1HMEN1
SCHEMBL22778947 0.73 CACNA1H (0.40) ALDH1A1APPNAMPTCACNA1HMEN1
SCHEMBL20153853 0.73 CCNC (0.48) KMT2ASMN1; SMN2KDM4EMAOB
SCHEMBL20674169 0.72 APP (0.40) ALDH1A1APPNAMPTCACNA1HMEN1
SCHEMBL3303776 0.72 HSD17B10 (0.46) ALDH1A1APPNAMPTCACNA1HMEN1
SCHEMBL22554301 0.72 HPGD (0.46) APPNAMPTCACNA1HMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12577243-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2026-03-17 US disclosed
WO-2024081653-A2 METHODS OF LOWERING MIRO2 TO TREAT NEURODEGENERATIVE DISEASES ACUREX BIOSCIENCES CORPORATION (US) 2024-04-18 WO disclosed
EP-4301759-A2 T-TYPE CALCIUM CHANNEL ANTAGONISTS AND USES THEREOF The Board of Trustees of the Leland Stanford Junior University (US) 2024-01-10 EP disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
CN-116917289-A T-type calcium channel antagonists and uses thereof 小利兰·斯坦福大学董事会 2023-10-20 CN disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 US disclosed
WO-2022216386-A9 T-TYPE CALCIUM CHANNEL ANTAGONISTS AND USES THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2022-12-01 WO disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 US disclosed
WO-2022216386-A2 T-TYPE CALCIUM CHANNEL ANTAGONISTS AND USES THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2022-10-13 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 (4 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-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP PTGER4 1203/4885ALDH1A1 312/4885RXFP1 982/4885
US-12577243-B2 Monoacylglycerol lipase modulators MGLL, LPL, FAAH PTGER4 679/4885ALDH1A1 587/4885RXFP1 1092/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP PTGER4 1203/4885ALDH1A1 312/4885RXFP1 982/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP PTGER4 1203/4885ALDH1A1 312/4885RXFP1 982/4885

“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.