SCHEMBL18243741

SCHEMBL18243741

[CH2]CCc1ccc(C(Cl)(Cl)Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
TAAR1 Q96RJ0 2/20 0.35
MAOB P27338 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KCNH2 Q12809 1/20 0.31
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
PTPN6 P29350 1/20 0.31
PTPN11 Q06124 1/20 0.31

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
SCHEMBL18242341 0.86 TSHR (0.37) TSHRTAAR1MAOBKCNH2PTPN2
SCHEMBL18377981 0.82 TAAR1 (0.33) TAAR1PTPN2PTPN1PTPN6PTPN11
SCHEMBL5250772 0.80 TSHR (0.43) TSHR
SCHEMBL2745550 0.79 GFER (0.42) TAAR1MAOBKMT2A
SCHEMBL18243026 0.79 TAAR1 (0.31) TAAR1PTPN2PTPN1PTPN6PTPN11
SCHEMBL18378241 0.77 TAAR1 (0.42) TAAR1MAOBPTPN2PTPN1PTPN6
SCHEMBL18244096 0.77 TAAR1 (0.31) TAAR1PTPN2PTPN1PTPN6PTPN11
SCHEMBL18243544 0.76 TSHR (0.40) TSHRTAAR1MAOBMEN1KMT2A
SCHEMBL398644 0.76 TAAR1 (0.61) TAAR1MAOBKMT2A
SCHEMBL8082952 0.76 LPL (0.45) TSHRTAAR1MAOB

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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-22 US disclosed
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2016-11-24 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 (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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical CBR1, HAO2, CBR3 TSHR 648/4885TAAR1 1102/4885MAOB 785/4885
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL CBR1, HAO2, CBR3 TSHR 648/4885TAAR1 1102/4885MAOB 785/4885

“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.