SCHEMBL6498396

SCHEMBL6498396

COc1ccc2ccccc2c1C=Cc1ccncc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.61
LMNA P02545 1/20 0.61
HPGD P15428 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 1/20 0.53
KDM4E B2RXH2 3/20 0.52
CYP1A2 P05177 4/20 0.52
CYP3A4 P08684 2/20 0.52
CYP2C9 P11712 2/20 0.52
CYP2C19 P33261 2/20 0.52
MTNR1A P48039 1/20 0.52
MTNR1B P49286 1/20 0.52
BACE1 P56817 1/20 0.52
NFE2L2 Q16236 1/20 0.48
HSP90AA1 P07900 1/20 0.47
HSD17B10 Q99714 1/20 0.47
NPC1 O15118 1/20 0.46
CYP2D6 P10635 1/20 0.46
RAB9A P51151 1/20 0.46
CYP1A1 P04798 4/20 0.44

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
SCHEMBL2604927 1.00 MAPT (0.61) MAPTLMNAHPGDSMN1; SMN2ALDH1A1
SCHEMBL2604953 0.89 BACE1 (0.61) MAPTLMNAHPGDSMN1; SMN2ALDH1A1
SCHEMBL2604931 0.88 CYP1A2 (0.61) MAPTHPGDKDM4ECYP1A2CYP3A4
SCHEMBL6499271 0.85 POLB (0.56) MAPTLMNAHPGDSMN1; SMN2ALDH1A1
SCHEMBL29227143 0.82 CYP1A1 (0.47) MAPTLMNAHPGDSMN1; SMN2ALDH1A1
SCHEMBL29227146 0.82 CYP1A1 (0.47) MAPTLMNAHPGDSMN1; SMN2ALDH1A1
SCHEMBL6496200 0.82 MEN1 (0.55) MAPTLMNAHPGDSMN1; SMN2ALDH1A1
SCHEMBL2604951 0.82 CYP1A2 (0.55) MAPTHPGDKDM4ECYP1A2CYP3A4
SCHEMBL6495751 0.82 CYP1A2 (0.49) MAPTLMNAHPGDSMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL6491093 0.81 MEN1 (0.54) MAPTLMNAHPGDSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6846830-B2 Naphtalene derivatives and their pharmaceutical use ELI LILLY AND COMPANY (US) 2005-01-25 US claimed
US-6846830-B2 Naphtalene derivatives and their pharmaceutical use ELI LILLY AND COMPANY (US) 2005-01-25 US disclosed
US-20030073725-A1 Naphtalene derivatives and their pharmaceutical use ELI LILLY AND COMPANY 2003-04-17 US disclosed
EP-1272469-A1 NAPHTHALENE DERIVATIVES AND THEIR PHARMACEUTICAL USE ELI LILLY AND COMPANY (US) 2003-01-08 EP disclosed
EP-1138328-A1 Naphthalene derivatives as CNS drugs ELI LILLY AND COMPANY LIMITED (GB) 2001-10-04 EP disclosed
WO-2001072709-A1 NAPHTALENE DERIVATIVES AND THEIR PHARMACEUTICAL USE ELI LILLY AND COMPANY (US) 2001-10-04 WO 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-20030073725-A1 Naphtalene derivatives and their pharmaceutical use CHRNA6, ATP6V1B2, GRM6 MAPT 2452/4885LMNA 3238/4885HPGD 1020/4885

“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.