SCHEMBL892160

SCHEMBL892160

CCCCCCCCCCOc1ccc(-c2nc3c(Br)ccc(Br)c3nc2-c2ccc(OCCCCCCCCCC)c(OCCCCCCCCCC)c2)cc1OCCCCCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.42
PTPN1 P18031 1/20 0.40
PTPN6 P29350 1/20 0.40
S1PR1 P21453 1/20 0.40
SMPD1 P17405 3/20 0.40
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
MCHR1 Q99705 2/20 0.39
TLR8 Q9NR97 1/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38

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
SCHEMBL17465202 0.93 S1PR1 (0.45) PTPN11PTPN1PTPN6S1PR1SMPD1
SCHEMBL6737580 0.90 PTPN11 (0.44) PTPN11PTPN1PTPN6SMPD1MCHR1
SCHEMBL30475756 0.82 NR5A1 (0.49)
SCHEMBL28252092 0.82 NR5A1 (0.49)
SCHEMBL14182502 0.82 NR5A1 (0.49)
SCHEMBL14182510 0.82 NR5A1 (0.49)
SCHEMBL30398576 0.80 TSHR (0.50) PTPN11SMPD1
SCHEMBL15158960 0.80 TSHR (0.50) PTPN11SMPD1
SCHEMBL2856448 0.79 PTPN11 (0.55) PTPN11PTPN1PTPN6SMPD1
SCHEMBL13957128 0.79 PTPN11 (0.55) PTPN11PTPN1PTPN6SMPD1

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
WO-2009126118-A1 UNIQUE PROCESSABLE GREEN POLYMER WITH A TRANSMISSIVE OXIDIZED STATE FOR REALIZATION OF COMMERICAL RGB BASED ELECTROCHROMIC DEVICE APPLICATIONS TOPPARE LEVENT KAMIL (TR) 2009-10-15 WO claimed
US-8324400-B2 Benzotriazole containing donor-acceptor type polymer as a multi-purpose material TOPPARE LEVENT KAMIL (TR) 2012-12-04 US disclosed
US-20120083583-A1 BENZOTRIAZOLE CONTAINING DONOR-ACCEPTOR TYPE POLYMER AS A MULTI-PURPOSE MATERIAL TOPPARE LEVENT KAMIL (TR) 2012-04-05 US disclosed
WO-2010114497-A1 BENZOTRIAZOLE CONTAINING DONOR-ACCEPTOR TYPE POLYMER AS A MULTI-PURPOSE MATERIAL TOPPARE LEVENT KAMIL (TR) 2010-10-07 WO disclosed
US-20100249367-A1 BENZOTRIAZOLE CONTAINING DONOR-ACCEPTOR TYPE POLYMER AS A MULTI-PURPOSE MATERIAL TOPPARE LEVENT KAMIL 2010-09-30 US disclosed
WO-2009126118-A1 UNIQUE PROCESSABLE GREEN POLYMER WITH A TRANSMISSIVE OXIDIZED STATE FOR REALIZATION OF COMMERICAL RGB BASED ELECTROCHROMIC DEVICE APPLICATIONS TOPPARE LEVENT KAMIL (TR) 2009-10-15 WO disclosed
WO-2009126118-A1 UNIQUE PROCESSABLE GREEN POLYMER WITH A TRANSMISSIVE OXIDIZED STATE FOR REALIZATION OF COMMERICAL RGB BASED ELECTROCHROMIC DEVICE APPLICATIONS TOPPARE LEVENT KAMIL (TR) 2009-10-15 WO 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-20100249367-A1 BENZOTRIAZOLE CONTAINING DONOR-ACCEPTOR TYPE POLYMER AS A MULTI-PURPOSE MATERIAL TYR, AADAT, BHMT2 PTPN11 1398/4885PTPN1 3415/4885PTPN6 2687/4885

“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.