SCHEMBL890382

SCHEMBL890382

Nc1ccc(C(=O)CCC(=O)O)c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 4/20 0.51
▸ ALDH1A1 P00352 3/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ HSD17B10 Q99714 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ GLA P06280 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ ADAM17 P78536 1/20 0.51
▸ NR4A2 P43354 1/20 0.48
▸ NSD2 O96028 2/20 0.45
▸ GAA P10253 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ FFAR1 O14842 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ PARP1 P09874 1/20 0.43

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
SCHEMBL11705940 0.81 ALDH1A1 (0.53) CYP1A2ALDH1A1KMT2AHSD17B10KDM4E
SCHEMBL14124751 0.79 KMT2A (0.56) CYP1A2ALDH1A1KMT2AHSD17B10KDM4E
SCHEMBL7336041 0.78 NR4A2 (0.55) CYP1A2ALDH1A1KMT2AHSD17B10KDM4E
SCHEMBL629199 0.77 CDC25B (0.54) ALDH1A1KMT2AHSD17B10KDM4EGLA
SCHEMBL20644867 0.77 CYP1A2 (0.49) CYP1A2ALDH1A1KMT2AHSD17B10KDM4E
Glutarate SCHEMBL28854333 0.76 PARP1 (0.57) ALDH1A1KMT2AHSD17B10KDM4EPOLB
Hydrochloric Acid SCHEMBL5750101 0.76 CDC25B (0.53) ALDH1A1KMT2AHSD17B10KDM4EGLA
Menbutone SCHEMBL30277792 0.76 CYP2C9 (0.69) CYP1A2ALDH1A1KMT2AHSD17B10KDM4E
Menbutone SCHEMBL1641812 0.76 CYP2C9 (0.69) CYP1A2ALDH1A1KMT2AHSD17B10KDM4E
SCHEMBL818033 0.75 ALDH1A1 (0.63) CYP1A2ALDH1A1KMT2AHSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120321560-A1 Method for Obtaining Novel Derivatives of Naphthalene for the In Vivo Diagnosis of Alzheimer's Disease CENTRO DE NEUROCIENCIAS DE CUBA (CU) 2012-12-20 — — US claimed
US-10155053-B2 Method for obtaining novel derivatives of naphthalene for the in vivo diagnosis of Alzheimer's disease CENTRO DE NEUROCIENCIAS DE CUBA (CU) 2018-12-18 — — US disclosed
EP-2860169-B1 Method for obtaining novel derivatives of naphtalene for the in vivo diagnosis of Alzheimer's disease CENTRO DE NEUROCIENCIAS DE CUBA (CU) 2018-08-29 — — EP disclosed
US-9764047-B2 Method for obtaining novel derivatives of naphthalene for the in vivo diagnosis of alzheimer's disease CENTRO DE NEUROCIENCIAS DE CUBA (CU) 2017-09-19 — — US disclosed
US-20150217005-A1 METHOD FOR OBTAINING NOVEL DERIVATIVES OF NAPHTHALENE FOR THE IN VIVO DIAGNOSIS OF ALZHEIMER'S DISEASE SABLON CARRAZANA MARQUIZA (CU) 2015-08-06 — — US disclosed
EP-2860169-A2 Method for obtaining novel derivatives of naphtalene for the in vivo diagnosis of Alzheimer's disease Centro De Neurociencias De Cuba (CU) 2015-04-15 — — EP disclosed
US-20120321560-A1 Method for Obtaining Novel Derivatives of Naphthalene for the In Vivo Diagnosis of Alzheimer's Disease CENTRO DE NEUROCIENCIAS DE CUBA (CU) 2012-12-20 — — US disclosed
EP-2436666-A2 METHOD FOR OBTAINING NOVEL DERIVATIVES OF NAPHTALENE FOR THE IN VIVO DIAGNOSIS OF ALZHEIMER 'S DISEASE Centro De Neurociencias De Cuba (CU) 2012-04-04 — — 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 (3 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-20120321560-A1 Method for Obtaining Novel Derivatives of Naphthalene for the In Vivo Diagnosis of Alzheimer's Disease SLC43A1, SLCO2B1, SLCO2A1 CYP1A2 1183/4885ALDH1A1 1269/4885KMT2A 2327/4885
US-20150217005-A1 METHOD FOR OBTAINING NOVEL DERIVATIVES OF NAPHTHALENE FOR THE IN VIVO DIAGNOSIS OF ALZHEIMER'S DISEASE SLC43A1, SLCO2B1, FABP7 CYP1A2 1126/4885ALDH1A1 1358/4885KMT2A 2355/4885
US-10155053-B2 Method for obtaining novel derivatives of naphthalene for the in vivo diagnosis of Alzheimer's disease SLC43A1, SLCO2B1, FABP7 CYP1A2 1126/4885ALDH1A1 1358/4885KMT2A 2355/4885

“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.

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