SCHEMBL887362

SCHEMBL887362

O=P1(O)Sc2ccc3ccccc3c2-c2c(ccc3ccccc23)S1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.50
WDR5 P61964 1/20 0.43
ALDH1A1 P00352 1/20 0.39
CYP2A6 P11509 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
KDM4E B2RXH2 2/20 0.38
DNMT1 P26358 1/20 0.38
HPRT1 P00492 1/20 0.37
MAPT P10636 2/20 0.36
CES1 P23141 1/20 0.36
PTPN22 Q9Y2R2 1/20 0.35
PAX8 Q06710 1/20 0.35

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
SCHEMBL887393 0.79 GPR84 (0.65) GPR84WDR5ALDH1A1TSHRHSD17B10
SCHEMBL10042108 0.73 ALDH1A1 (0.52) GPR84WDR5ALDH1A1CYP2A6TSHR
SCHEMBL7905100 0.68 MEN1 (0.54) WDR5ALDH1A1CYP2A6TSHRHSD17B10
SCHEMBL29726541 0.67 GPR84 (1.00) GPR84MEN1KMT2AKDM4E
SCHEMBL296014 0.67 GPR84 (1.00) GPR84MEN1KMT2AKDM4E
SCHEMBL887292 0.67 GPR84 (0.50) GPR84WDR5ALDH1A1CYP2A6TSHR
SCHEMBL13935985 0.65 HSD17B10 (0.42) GPR84WDR5ALDH1A1CYP2A6TSHR
SCHEMBL21436428 0.64 MAPT (0.54) GPR84WDR5ALDH1A1CYP2A6TSHR
SCHEMBL87603 0.63 DNMT1 (0.42) GPR84WDR5ALDH1A1CYP2A6TSHR
SCHEMBL15400598 0.62 PTPN22 (0.65) WDR5ALDH1A1CYP2A6TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902207-B2 Process for production of amines TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-03-08 US disclosed
US-7902207-B2 Process for production of amines TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-03-08 US disclosed
US-20070142639-A1 Process for production of amines TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-06-21 US disclosed
US-20070142639-A1 Process for production of amines TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-06-21 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-20070142639-A1 Process for production of amines SMS, CCNT1, PEAK1 GPR84 2711/4885WDR5 2849/4885ALDH1A1 1001/4885

“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.