SCHEMBL2379635

SCHEMBL2379635

NC(=O)CCCCCc1c[nH]c2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
MPO P05164 5/20 0.64
GAA P10253 1/20 0.61
MAPT P10636 1/20 0.61
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
NAAA Q02083 1/20 0.59
CYP1A2 P05177 2/20 0.59
CYP3A4 P08684 2/20 0.59
CYP2D6 P10635 2/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
SLC6A4 P31645 1/20 0.58
KDM4E B2RXH2 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
MTNR1A P48039 1/20 0.57
CYP2A6 P11509 1/20 0.57
NFKB1 P19838 1/20 0.57
HTR1D P28221 1/20 0.57

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
SCHEMBL2378991 0.98 ALDH1A1 (0.69) ALDH1A1MPOGAAMAPTMEN1
SCHEMBL4092371 0.94 ALDH1A1 (0.75) ALDH1A1MPOGAAMAPTMEN1
SCHEMBL664283 0.89 MAPT (0.70) ALDH1A1MPOGAAMAPTMEN1
SCHEMBL1305574 0.88 MEN1 (0.60) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL27531911 0.88 MEN1 (0.60) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL29053759 0.88 MAPT (0.68) ALDH1A1MPOGAAMAPTMEN1
SCHEMBL19612658 0.87 MEN1 (0.59) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL2379006 0.86 MEN1 (0.62) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL1233177 0.85 MEN1 (0.81) ALDH1A1MAPTMEN1KMT2ACYP1A2
SCHEMBL7889427 0.85 HTR2A (0.69) ALDH1A1MPOMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118084889-A Indole 3-aryl-5-carboxamide derivative and application thereof 宁夏医科大学 2024-05-28 CN claimed
CN-118084889-A Indole 3-aryl-5-carboxamide derivative and application thereof 宁夏医科大学 2024-05-28 CN disclosed
CN-118084889-A Indole 3-aryl-5-carboxamide derivative and application thereof 宁夏医科大学 2024-05-28 CN disclosed
CN-118084889-A Indole 3-aryl-5-carboxamide derivative and application thereof 宁夏医科大学 2024-05-28 CN disclosed
US-8017630-B2 Cyclohexylacetic acid compounds GRUENENTHAL GMBH (DE) 2011-09-13 US disclosed
EP-1751093-B1 SUBSTITUTED CYCLOHEXYLACETIC ACID DERIVATIVES GRUENENTHAL GMBH (DE) 2010-10-06 EP disclosed
US-20070129347-A1 Cyclohexylacetic acid compounds GRUENENTHAL GMBH (DE) 2007-06-07 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-20070129347-A1 Cyclohexylacetic acid compounds ACACA, HCAR2, PCCA ALDH1A1 168/4885MPO 3385/4885GAA 10/4885

“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.