SCHEMBL5358152

SCHEMBL5358152

N#CCNCCc1ccc(F)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.58
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA4 P22748 2/20 0.58
TAAR1 Q96RJ0 4/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
LMNA P02545 1/20 0.47
CYP1A2 P05177 2/20 0.46
CYP2D6 P10635 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2C9 P11712 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LTA4H P09960 1/20 0.45
EPHX2 P34913 1/20 0.45
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44
TRPV6 Q9H1D0 1/20 0.43
KCNH2 Q12809 1/20 0.42

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
SCHEMBL6663240 0.80 LMNA (0.59) L3MBTL1LMNACYP2D6CYP2C19CYP2C9
SCHEMBL2238594 0.80 CA12 (0.57) CA12CA1CA2CA4TAAR1
SCHEMBL15662443 0.78 CA12 (0.55) CA12CA1CA2CA4LMNA
SCHEMBL8442802 0.78 L3MBTL1 (0.67) CA12CA1CA2CA4TAAR1
SCHEMBL7931494 0.76 L3MBTL1 (0.65) CA12CA1CA2CA4TAAR1
SCHEMBL12342243 0.74 TAAR1 (0.59) CA12CA1CA2CA4TAAR1
SCHEMBL5224472 0.74 TAAR1 (0.57) CA12CA1CA2CA4TAAR1
SCHEMBL12500537 0.74 KDM4E (0.69) TAAR1L3MBTL1CYP1A2CYP2D6CYP2C19
SCHEMBL31084266 0.73 MAPT (0.61) CA12CA1CA2CA4TAAR1
SCHEMBL681435 0.73 TAAR1 (1.00) TAAR1L3MBTL1LMNACYP1A2KDM4E

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-7217723-B2 Substituted benzothiophenes, e.g., 7Z)-7-hydroxyimino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-sulfonic acid [2-(4-fluorophenyl)-2-hydroxyethyl]-methyl-amide; treating allergies such as atopic dermatitis, allergic coryza, bronchial asthma, hypersensitive pneumoniac and pulmonary aspergillosis. EISAI CO., LTD. (JP) 2007-05-15 US disclosed
US-20050227959-A1 Heterocyclic compound having oxime group EISAI CO., LTD. (JP) 2005-10-13 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-20050227959-A1 Heterocyclic compound having oxime group STAT6, HRH4, HRH2 CA12 557/4885CA1 482/4885CA2 99/4885

“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.