SCHEMBL2491455

SCHEMBL2491455

CCCCOc1onc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.48
MGLL Q99685 1/20 0.48
TLR8 Q9NR97 3/20 0.44
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.43
NPY1R P25929 1/20 0.43
NPY2R P49146 1/20 0.43
MPO P05164 2/20 0.41
CYP1A2 P05177 4/20 0.40
CYP2C9 P11712 4/20 0.40
CYP2C19 P33261 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
CYP19A1 P11511 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
LTA4H P09960 2/20 0.40

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
SCHEMBL2494284 0.84 ELANE (0.45) FAAHMGLLTLR8ALDH1A1L3MBTL1
SCHEMBL7144568 0.81 KMT2A (0.33) FAAHMGLLALDH1A1L3MBTL1LMNA
SCHEMBL2490792 0.74 POLB (0.45) ALDH1A1LMNAMPOCYP1A2CYP2C19
SCHEMBL2493164 0.72 PARP1 (0.43) FAAHMGLLTLR8ALDH1A1LMNA
SCHEMBL10396514 0.71 ATM (0.46) FAAHMGLLTLR8ALDH1A1LMNA
SCHEMBL19583344 0.70 POLB (0.55) TLR8ALDH1A1L3MBTL1LMNANPY1R
SCHEMBL2492592 0.70 LMNA (0.47) FAAHMGLLTLR8ALDH1A1LMNA
SCHEMBL2490785 0.70 LMNA (0.47) FAAHMGLLTLR8ALDH1A1LMNA
SCHEMBL31301176 0.68 MAPT (0.50) ALDH1A1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL16836384 0.68 TLR8 (0.49) TLR8ALDH1A1L3MBTL1LMNANPY1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030438-B2 Thiophene compound having phosphoric ester and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-10-04 US disclosed
US-20100019229-A1 Thiophene compound having phosphoric ester and process for producing the same NISSAN CHEMICAL INDUSTRIES, LTD (JP) 2010-01-28 US disclosed
EP-1882694-A1 THIOPHENE COMPOUND HAVING PHOSPHORIC ESTER AND PROCESS FOR PRODUCING THE SAME Nissan Chemical Industries, Ltd. (JP) 2008-01-30 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-20100019229-A1 Thiophene compound having phosphoric ester and process for producing the same RRP12, NR2E1, TST FAAH 3325/4885MGLL 3626/4885TLR8 782/4885

“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.