SCHEMBL7921629

SCHEMBL7921629

Nc1ccc(Cl)c(C2OCCO2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.45
TSHR P16473 2/20 0.45
MAPT P10636 4/20 0.40
GAA P10253 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 4/20 0.34
POLB P06746 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
ALOX12 P18054 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX15 P16050 2/20 0.32

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
SCHEMBL7583374 0.80 TP53 (0.41) CYP3A4TSHRNPC1RAB9AALDH1A1
SCHEMBL1539261 0.77 NPC1 (0.36) MAPTSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL21962283 0.77 KDM1A (0.35) MAPTGAANPC1ALDH1A1CHRNB2
SCHEMBL30739381 0.77 CHRNB2 (0.34) MAPTGAACA1CA2ALDH1A1
SCHEMBL3792282 0.74 CYP3A4 (0.50) CYP3A4TSHRMAPTGAASMN1; SMN2
SCHEMBL7090123 0.73 KDM4E (0.42) TSHRMAPTGAASMN1; SMN2NPC1
SCHEMBL3202257 0.73 KIF11 (0.38) SMN1; SMN2NPC1RAB9AALDH1A1LMNA
SCHEMBL29045096 0.72 DRD2 (0.46)
SCHEMBL3214155 0.71 KMT2A (0.49) TSHRGAASMN1; SMN2NPC1RAB9A
SCHEMBL3786817 0.71 CYP3A4 (0.46) CYP3A4TSHRMAPTSMN1; SMN2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010031865-A1 Substituted 3-phenyluracils KLINTZ RALF (DE) 2001-10-18 US disclosed
US-6239074-B1 HERBICIDES, INSECTICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-05-29 US disclosed
US-5914351-A Anti-viral aromatic hydrazones UNIROYAL CHEMICAL COMPANY, INC. (US) 1999-06-22 US disclosed
EP-0414112-B1 Herbicides thiadiazabicyclononan derivatives BASF AG (DE) 1995-12-20 EP disclosed
EP-0400427-B1 Herbicidal 5-(N-3,4,5,6-tetrahydrophthalimido)-cinnamic acid esters, process for their preparation and their use BASF AG (DE) 1995-04-05 EP disclosed
EP-0604491-A1 SUBSTITUTED 3-PHENYLURACILS AS HERBICIDES BASF Aktiengesellschaft (DE) 1994-07-06 EP disclosed
WO-1993006090-A1 SUBSTITUTED 3-PHENYLURACILS AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-04-01 WO disclosed
EP-0345637-B1 N-SUBSTITUTED 3,4,5,6-TETRAHYDROPHTHALIMIDE DERIVATIVES BASF Aktiengesellschaft (DE) 1993-03-17 EP disclosed
US-5106408-A Pre- and postemergence BASF AKTIENGESELLSCHAFT (DE) 1992-04-21 US disclosed
EP-0414112-A2 Herbicides thiadiazabicyclononan derivatives BASF Aktiengesellschaft (DE) 1991-02-27 EP disclosed
EP-0400427-A1 Herbicidal 5-(N-3,4,5,6-tetrahydrophthalimido)-cinnamic acid esters, process for their preparation and their use BASF Aktiengesellschaft (DE) 1990-12-05 EP disclosed
US-4959098-A HERBICIDES, PLANT GROWTH REGULATORS BASF AKTIENGESELLSCHAFT (DE) 1990-09-25 US disclosed
EP-0345637-A1 N-substituted 3,4,5,6-tetrahydrophthalimide derivatives BASF Aktiengesellschaft (DE) 1989-12-13 EP 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-20010031865-A1 Substituted 3-phenyluracils CCR1, CCR6, CCR3 CYP3A4 1383/4885TSHR 1263/4885MAPT 4647/4885

“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.