SCHEMBL5827600

SCHEMBL5827600

Nc1cccc(CC2=NCCN2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR1B P28222 4/20 0.68
▸ TAAR1 Q96RJ0 9/20 0.65
▸ CYP2D6 P10635 3/20 0.65
▸ ADRA2A P08913 3/20 0.65
▸ ADRA2B P18089 3/20 0.65
▸ ADRA2C P18825 3/20 0.65
▸ ADRA1A P35348 3/20 0.65
▸ ADRA1D P25100 2/20 0.65
▸ ADRA1B P35368 2/20 0.65
▸ LMNA P02545 2/20 0.65
▸ CYP1A2 P05177 1/20 0.65
▸ TSHR P16473 1/20 0.65
▸ NFKB1 P19838 1/20 0.59
▸ RAD52 P43351 1/20 0.56
▸ HTR1D P28221 6/20 0.53
▸ NISCH Q9Y2I1 2/20 0.50
▸ MAOA P21397 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ HTR1A P08908 1/20 0.48
▸ MAPT P10636 1/20 0.48

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
SCHEMBL5826973 0.86 MAOA (0.66) HTR1BTAAR1CYP2D6ADRA2AADRA2B
SCHEMBL14340604 0.81 HTR1B (0.68) HTR1BTAAR1CYP2D6ADRA2AADRA2B
SCHEMBL953972 0.80 RAD52 (0.82) HTR1BTAAR1CYP2D6ADRA2AADRA2B
Tolazoline SCHEMBL34961 0.79 TAAR1 (1.00) HTR1BTAAR1CYP2D6ADRA2AADRA2B
SCHEMBL11130145 0.78 NISCH (0.68) HTR1BTAAR1CYP2D6ADRA2AADRA2B
Tolazoline SCHEMBL5053858 0.78 TAAR1 (1.00) HTR1BTAAR1CYP2D6ADRA2AADRA2B
Tolazoline SCHEMBL28254903 0.78 TAAR1 (0.96) HTR1BTAAR1CYP2D6ADRA2AADRA2B
Tolazoline SCHEMBL34869 0.78 TAAR1 (1.00) HTR1BTAAR1CYP2D6ADRA2AADRA2B
Tolazoline SCHEMBL9614505 0.78 TAAR1 (1.00) HTR1BTAAR1CYP2D6ADRA2AADRA2B
SCHEMBL953586 0.77 HTR1B (0.62) HTR1BTAAR1CYP2D6ADRA2AADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7026357-B2 Diphenylurea compounds LES LABORATOIRES SERVIER (FR) 2006-04-11 — — US disclosed
EP-1170288-B9 Diphenylureum derivatives and their use as alpha2/5-HT2c antagonists SERVIER LAB (FR) 2005-01-26 — — EP disclosed
US-20040224993-A1 Diphenylurea compounds LAVIELLE GILBERT (FR) 2004-11-11 — — US disclosed
US-6784183-B2 ANTISEROTONINE AGENTS LES LABORATOIRES SERVIER (FR) 2004-08-31 — — US disclosed
EP-1170288-B1 Diphenylureum derivatives and their use as alpha2/5-HT2c antagonists SERVIER LAB (FR) 2004-08-11 — — EP disclosed
US-20020025965-A1 Antiserotonine agents ADIR ET COMPAGNIE (FR) 2002-02-28 — — US disclosed
EP-1170288-A2 Diphenylureum derivatives and their use as alpha2/5-HT2c antagonists LES LABORATOIRES SERVIER (FR) 2002-01-09 — — 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 (2 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-20020025965-A1 Antiserotonine agents HTR2C, HTR3C, HTR3A HTR1B 12/4885TAAR1 99/4885CYP2D6 648/4885
US-20040224993-A1 Diphenylurea compounds HTR2C, HTR2A, HTR1A HTR1B 4/4885TAAR1 224/4885CYP2D6 194/4885

“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.

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