SCHEMBL7333435

SCHEMBL7333435

c1ccc(-c2nc(CN3CCCCC3)c[nH]2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 7/20 0.54
CYP2D6 P10635 4/20 0.54
CYP1A2 P05177 3/20 0.54
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
HSD17B10 Q99714 2/20 0.51
GRIN1 Q05586 1/20 0.48
RAB9A P51151 2/20 0.43
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
HTT P42858 2/20 0.43
LMNA P02545 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.42
JAK2 O60674 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41

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
SCHEMBL8865562 0.87 SIGMAR1 (0.50) GRIN2BCYP2D6CYP1A2LMNASIGMAR1
SCHEMBL8677037 0.84 DRD4 (0.58) KDM4EDRD2DRD4DRD3
Hydrochloric Acid SCHEMBL7423933 0.83 DRD4 (0.56) KDM4EDRD2DRD4DRD3
SCHEMBL8964119 0.81 LMNA (0.53) KMT2AATMHTTLMNACYP2C19
Hydrochloric Acid SCHEMBL7420060 0.81 GRIN2B (0.52) GRIN2BKDM4EALDH1A1KMT2ASIGMAR1
SCHEMBL6901339 0.81 DRD4 (0.60) CYP2D6KDM4EALDH1A1HSD17B10KMT2A
SCHEMBL27465127 0.79 DRD4 (0.62) KDM4EALDH1A1RAB9AKMT2AHTT
SCHEMBL12204393 0.79 ALDH1A1 (0.56) KDM4EALDH1A1LMNADRD2DRD4
Hydrochloric Acid SCHEMBL7421744 0.78 ALDH1A1 (0.55) KDM4EALDH1A1LMNADRD2DRD4
Hydrochloric Acid SCHEMBL8675895 0.78 ALDH1A1 (0.54) KDM4EALDH1A1HSD17B10KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240245670-A1 DOSING REGIMEN AND PHARMACEUTICAL COMBINATION COMPRISING 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES NOVARTIS AG (CH) 2024-07-25 US disclosed
US-6166205-A 2-Aryl-4-(1-[4-heteroaryl]piperazin-1-yl)methylimidazoles: dopamine . D.sub4 receptor subtype ligands NEUROGEN CORPORATION (US) 2000-12-26 US disclosed
WO-2000012500-A2 2-ARYL-4-(1-[4-HETEROARYL]PIPERAZIN-1-YL) METHYLIMIDAZOLES: DOPAMINE D4 RECEPTOR SUBTYPE LIGANDS NEUROGEN CORPORATION (US) 2000-03-09 WO disclosed
US-5633376-A Certain aminomethyl phenylimidazole derivatives; and 4-aryl substituted piperazinyl and piperidinylmethyl phenylimidazole derivatives; a new class of dopamine receptor subtype ligands NEUROGEN CORPORATION (US) 1997-05-27 US disclosed
US-5428164-A Useful for treating and diagnosis of schizophrenia and depression as well as parkinson's disease NEUROGEN CORPORATION (US) 1995-06-27 US 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-20240245670-A1 DOSING REGIMEN AND PHARMACEUTICAL COMBINATION COMPRISING 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES IKZF1, IKZF2, IKZF3 GRIN2B 3733/4885CYP2D6 1576/4885CYP1A2 2248/4885

“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.