SCHEMBL5319656

SCHEMBL5319656

COc1ccccc1OCCN1CCOCC1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.70
TDP1 Q9NUW8 1/20 0.70
CYP2D6 P10635 1/20 0.65
TSHR P16473 1/20 0.65
DRD1 P21728 1/20 0.62
DRD4 P21917 1/20 0.62
DRD5 P21918 1/20 0.62
SYK P43405 1/20 0.61
ALDH1A1 P00352 1/20 0.60
POLB P06746 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.56

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
Ammonia Solution, Strong SCHEMBL4267670 0.98 KDM4E (0.68) KDM4ETDP1CYP2D6TSHRDRD1
SCHEMBL4661122 0.91 KDM4E (0.60) KDM4ETDP1CYP2D6TSHRDRD1
SCHEMBL14578233 0.87 DRD1 (0.65) KDM4ETDP1CYP2D6TSHRDRD1
SCHEMBL13744516 0.87 SMN1; SMN2 (0.66) KDM4ETDP1CYP2D6TSHRDRD1
SCHEMBL12661473 0.85 POLB (0.73) TDP1CYP2D6TSHRDRD1DRD4
SCHEMBL12058633 0.84 TDP1 (0.74) KDM4ETDP1CYP2D6DRD1DRD4
SCHEMBL13963827 0.82 SYK (0.71) KDM4ETDP1CYP2D6TSHRSYK
SCHEMBL12409038 0.82 SYK (0.71) KDM4ETDP1CYP2D6TSHRSYK
SCHEMBL13791083 0.82 SYK (0.59) KDM4ETSHRSYKALDH1A1SMN1; SMN2
SCHEMBL4024630 0.82 DRD1 (0.71) KDM4ETDP1DRD1DRD4DRD5

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-20240239774-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2024-07-18 US disclosed
WO-2017167183-A1 DIARYL-Β-LACTAM COMPOUND AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF 复旦大学 2017-10-05 WO disclosed
WO-2007076161-A2 COMPOUNDS WITH THERAPEUTIC ACTIVITY MYRIAD GENETICS, INC (US) 2007-07-05 WO disclosed
EP-0633259-B1 Sulfonylaminopyrimidines, their preparation and their use as medicine HOFFMANN LA ROCHE (CH) 1999-01-13 EP disclosed
US-5541186-A ENDOTHELIN RECEPTOR INHIBITORS HOFFMANN-LA ROCHE INC. (US) 1996-07-30 US disclosed
EP-0633259-A1 Sulfonylaminopyrimidines, their preparation and their use as medicine F. HOFFMANN-LA ROCHE AG (CH) 1995-01-11 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-20240239774-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF UACA, ADCYAP1R1, ADCY1 KDM4E 4664/4885TDP1 2510/4885CYP2D6 1242/4885

“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.