SCHEMBL8946758

SCHEMBL8946758

CC1(C)c2ccccc2C2Nc3ccccc3C21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.37
PDK2 Q15119 1/20 0.35
PDK4 Q16654 1/20 0.35
HTR5A P47898 3/20 0.34
CYP3A4 P08684 2/20 0.33
PBRM1 Q86U86 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
MEN1 O00255 1/20 0.33
CYP2D6 P10635 1/20 0.33
ALOX15 P16050 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
BCHE P06276 1/20 0.33
CHRM5 P08912 1/20 0.33
TSHR P16473 1/20 0.33
ALOX12 P18054 1/20 0.33
NFKB1 P19838 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL8946756 1.00 HTR2A (0.37) HTR2APDK2PDK4HTR5ACYP3A4
SCHEMBL8946755 1.00 HTR2A (0.37) HTR2APDK2PDK4HTR5ACYP3A4
SCHEMBL10381583 0.76 ALDH1A1 (0.42) HTR2AMAPK1
SCHEMBL8946738 0.70 HTR2A (0.33) HTR2AMEN1KMT2A
SCHEMBL8946739 0.70 HTR2A (0.33) HTR2AMEN1KMT2A
SCHEMBL8946736 0.70 HTR2A (0.33) HTR2AMEN1KMT2A
SCHEMBL18943506 0.70 HTR5A (0.37) HTR2AHTR5A
SCHEMBL18905201 0.69 NLRP3 (0.42) HTR5APBRM1TNKS2MEN1CYP2D6
SCHEMBL12362710 0.63 HTR2A (0.38) HTR2ACYP3A4MEN1CYP2D6ALOX15
SCHEMBL12629401 0.63 PDK2 (0.41) HTR2APDK2PDK4HTR5ACYP3A4

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
EP-0409410-B1 Indenoindole compounds UNIV BATH (GB) 1996-03-20 EP claimed
US-12030900-B2 Boron compound and organic light-emitting diode comprising same SFC CO., LTD. (KR) 2024-07-09 US disclosed
US-12030900-B2 Boron compound and organic light-emitting diode comprising same SFC CO., LTD. (KR) 2024-07-09 US disclosed
US-20220002319-A1 NOVEL BORON COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME SFC CO., LTD. (KR) 2022-01-06 US disclosed
US-5516788-A TREATMENT OF ATHEROSCLEROSIS; ANTIISCHEMIC, ANTICARCINOGENIC AGENTS; ANTICOAGULANTS UNIVERSITY OF BATH (GB) 1996-05-14 US disclosed
EP-0409410-B1 Indenoindole compounds UNIV BATH (GB) 1996-03-20 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-20220002319-A1 NOVEL BORON COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CLTB, CD79B, CYBA HTR2A 4365/4885PDK2 3276/4885PDK4 3474/4885
US-12030900-B2 Boron compound and organic light-emitting diode comprising same CLTB, CD79B, CYBA HTR2A 3903/4885PDK2 3095/4885PDK4 3022/4885

“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.