SCHEMBL7544109

SCHEMBL7544109

NNc1ccccc1Cl.O=C(O)c1cccc(S(=O)(=O)O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2B Q14289 2/20 0.66
KDM4E B2RXH2 1/20 0.66
TSHR P16473 1/20 0.66
MAPT P10636 2/20 0.52
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
RAB9A P51151 2/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
IL1RN P18510 1/20 0.47
F2 P00734 2/20 0.45
PRSS1 P07477 2/20 0.45
PRSS2 P07478 2/20 0.45
PRSS3 P35030 2/20 0.45
AKR1C3 P42330 4/20 0.45
AKR1C2 P52895 2/20 0.45
AKR1C1 Q04828 1/20 0.45

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
SCHEMBL7184686 0.86 TP53 (0.52) PTK2BKDM4ETSHRMAPTRAB9A
SCHEMBL7539656 0.85 CA1 (0.52) PTK2BKDM4ETSHRMAPTALDH1A1
SCHEMBL7542916 0.82 KDM4E (0.47) PTK2BKDM4ETSHRMAPTALDH1A1
Phenylhydrazine SCHEMBL7535360 0.82 CA1 (0.54) PTK2BKDM4ETSHRMAPTRAB9A
SCHEMBL7373672 0.80 KDM4E (1.00) PTK2BKDM4ETSHRMAPTALDH1A1
SCHEMBL31042233 0.80 LCK (0.63) PTK2BKDM4ETSHRMAPTALDH1A1
SCHEMBL135795 0.80 LCK (0.63) PTK2BKDM4ETSHRMAPTALDH1A1
SCHEMBL29812595 0.80 LCK (0.63) PTK2BKDM4ETSHRMAPTALDH1A1
SCHEMBL11174349 0.80 LCK (0.63) PTK2BKDM4ETSHRMAPTALDH1A1
SCHEMBL981408 0.80 LCK (0.63) PTK2BKDM4ETSHRMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 PTK2B 3993/4885KDM4E 3406/4885TSHR 4831/4885

“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.