SCHEMBL16385409

SCHEMBL16385409

COc1ccc(-c2cccc(C)n2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.48
CCR8 P51685 1/20 0.48
TGFBR1 P36897 2/20 0.48
MAPK14 Q16539 1/20 0.48
GRM5 P41594 3/20 0.44
TLR8 Q9NR97 1/20 0.43
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
CYP11B1 P15538 2/20 0.41
CYP11B2 P19099 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2A6 P11509 2/20 0.41
CYP1A1 P04798 1/20 0.41
CYP2E1 P05181 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C8 P10632 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL2614932 0.85 CYP1A1 (0.56) CCR1CCR8TGFBR1MAPK14GRM5
SCHEMBL21083327 0.85 TGFBR1 (0.51) CCR1CCR8TGFBR1MAPK14GRM5
SCHEMBL10304969 0.85 HSP90AA1 (0.44) TGFBR1TLR8MGAMGAASI
SCHEMBL2609405 0.81 TLR8 (0.40) TLR8MGAMGAASIMGAM2
SCHEMBL17033110 0.81 HSP90AA1 (0.55) CCR1CCR8TGFBR1MAPK14GRM5
SCHEMBL25562475 0.79 CCR1 (0.56) CCR1CCR8TGFBR1TLR8CYP1A2
SCHEMBL8817333 0.78 CRHR1 (0.46) TGFBR1MAPK14GAACYP1A2CYP3A4
SCHEMBL4726334 0.77 NPC1 (0.50) CCR1CCR8TGFBR1GRM5NPC1
SCHEMBL16385229 0.76 MEN1 (0.54) CCR1CCR8TGFBR1MAPK14MGAM
SCHEMBL8101860 0.76 CCR1 (0.52) CCR1CCR8TGFBR1CYP2A6NPC1

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-3020715-B1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2021-06-16 EP disclosed
US-9888688-B2 Tetrazolinone compounds and applications thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-13 US disclosed
US-9888688-B2 Tetrazolinone compounds and applications thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-13 US disclosed
US-20160150787-A1 TETRAZOLINONE COMPOUNDS AND APPLICATIONS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-06-02 US disclosed
US-20160150787-A1 TETRAZOLINONE COMPOUNDS AND APPLICATIONS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-06-02 US disclosed
WO-2015005499-A1 TETRAZOLINONE COMPOUND AND USE THEREOF 住友化学株式会社 (JP) 2015-01-15 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-20160150787-A1 TETRAZOLINONE COMPOUNDS AND APPLICATIONS THEREOF SOD1, UQCRB, MT-CO1 CCR1 1629/4885CCR8 3206/4885TGFBR1 1112/4885

“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.