SCHEMBL12190838

SCHEMBL12190838

c1ccc2c(c1)Cc1ccccc1N2c1cc(N2c3ccccc3Cc3ccccc32)cc(N2c3ccccc3Cc3ccccc32)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.53
ADRA2A P08913 3/20 0.40
ADRA2B P18089 2/20 0.40
ADRA2C P18825 2/20 0.40
NOTUM Q6P988 1/20 0.37
DRD1 P21728 3/20 0.37
DRD2 P14416 2/20 0.37
DRD4 P21917 2/20 0.37
DRD3 P35462 2/20 0.37
DRD5 P21918 1/20 0.37
MAOA P21397 2/20 0.36
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36
TUBB8 Q3ZCM7 1/20 0.36

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
SCHEMBL12190840 0.91 HPGD (0.55) HPGDADRA2AADRA2BADRA2CNOTUM
SCHEMBL6123772 0.88 HPGD (0.61) HPGDADRA2AADRA2BADRA2CNOTUM
SCHEMBL30420919 0.86 HPGD (0.70) HPGDADRA2AADRA2BADRA2CNOTUM
SCHEMBL496672 0.86 HPGD (0.70) HPGDADRA2AADRA2BADRA2CNOTUM
SCHEMBL17951467 0.84 HPGD (0.68) HPGDADRA2AADRA2BADRA2CDRD1
SCHEMBL11910206 0.84 HPGD (0.45) HPGDMAOAHTR2ALMNAHTR1A
SCHEMBL6123767 0.83 HPGD (0.61) HPGDADRA2AADRA2BADRA2CNOTUM
SCHEMBL6123837 0.82 HPGD (0.55) HPGDADRA2AADRA2BADRA2CNOTUM
Hydrochloric Acid SCHEMBL28173896 0.82 HPGD (0.66) HPGDADRA2AADRA2BADRA2CDRD2
SCHEMBL19344952 0.81 HPGD (0.42) HPGDADRA2AADRA2BADRA2CNOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8029919-B2 Phenothiazines, S-oxides, and S,S-dioxides as well as phenoxazines as emitters for OLEDs BASF AKTIENGESELLSCHAFT (DE) 2011-10-04 US disclosed
US-20100308714-A1 Phenothiazines, S-Oxides, And S,S-Dioxides As Well As Phenoxazines As Emitters For Oleds BASF AKTIENGESELLSCHAFT (DE) 2010-12-09 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-20100308714-A1 Phenothiazines, S-Oxides, And S,S-Dioxides As Well As Phenoxazines As Emitters For Oleds PPOX, SMOX, SORD HPGD 340/4885ADRA2A 464/4885ADRA2B 392/4885

“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.