SCHEMBL6131640

SCHEMBL6131640

CCc1cccc2c(CC(=O)O)c[nH]c12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.57
LMNA P02545 4/20 0.57
HTT P42858 3/20 0.57
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
MAPT P10636 4/20 0.50
RAB9A P51151 2/20 0.50
NPC1 O15118 1/20 0.50
MAPK1 P28482 1/20 0.50
CASP3 P42574 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
TDP1 Q9NUW8 2/20 0.49
TSHR P16473 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
UBE2N P61088 1/20 0.46
KDM4E B2RXH2 3/20 0.45
GAA P10253 2/20 0.45
HPGD P15428 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
GLA P06280 1/20 0.45

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
SCHEMBL5694492 0.92 TDP1 (0.53) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL14667559 0.84 ALDH1A1 (0.60) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL6284097 0.84 HTR2A (0.58) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL10368677 0.84 ALDH1A1 (0.51) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL17102847 0.83 ALDH1A1 (0.59) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL5058671 0.82 ALDH1A1 (0.46) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL27911679 0.81 GPR84 (0.59) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL5066540 0.81 GPR84 (0.65) ALDH1A1LMNAMEN1KMT2AMAPT
SCHEMBL5058656 0.81 ALDH1A1 (0.45) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL6516641 0.81 HTR2A (0.58) ALDH1A1LMNAHTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050107258-A1 Auxinic analogues of indole-3-acetic acid Life Technologies Corporation 2005-05-19 US claimed
US-6815205-B2 GENERATING PLANT ROOTS INVITROGEN CORPORATION 2004-11-09 US claimed
US-20030087762-A1 Auxinic analogues of indole-3-acetic acid LIFE TECHNOLOGIES, INC. 2003-05-08 US claimed
EP-0866850-A4 AUXINIC ANALOGUES OF INDOLE-3-ACETIC ACID LIFE TECHNOLOGIES INC (US) 2000-11-22 EP claimed
EP-0866850-A1 AUXINIC ANALOGUES OF INDOLE-3-ACETIC ACID LIFE TECHNOLOGIES, INC. (US) 1998-09-30 EP claimed
WO-1997020034-A9 AUXINIC ANALOGUES OF INDOLE-3-ACETIC ACID 1997-10-16 WO claimed
WO-1997020034-A1 AUXINIC ANALOGUES OF INDOLE-3-ACETIC ACID LIFE TECHNOLOGIES, INC. (US) 1997-06-05 WO claimed
US-20050107258-A1 Auxinic analogues of indole-3-acetic acid Life Technologies Corporation 2005-05-19 US disclosed
US-6815205-B2 GENERATING PLANT ROOTS INVITROGEN CORPORATION 2004-11-09 US disclosed
US-20030087762-A1 Auxinic analogues of indole-3-acetic acid LIFE TECHNOLOGIES, INC. 2003-05-08 US disclosed
US-6361999-B1 AMELIORATING DETRIMENTAL EFFECTS OF STRESS ON A PLANT OR PLANT TISSUE, SUCH AS ENVIRONMENTAL STRESS, PHYSICAL STRESS, CHEMICAL STRESS, FROM POLLUTION, CONTAMINATION, DROUGHT, AND LIGHT BY CONTACTING WITH AUXINIC INDOLE ACETIC ACID COMPOUND LIFE TECHNOLOGIES, INC. 2002-03-26 US disclosed
EP-0866850-A4 AUXINIC ANALOGUES OF INDOLE-3-ACETIC ACID LIFE TECHNOLOGIES INC (US) 2000-11-22 EP disclosed
EP-0866850-A1 AUXINIC ANALOGUES OF INDOLE-3-ACETIC ACID LIFE TECHNOLOGIES, INC. (US) 1998-09-30 EP disclosed
WO-1997020034-A9 AUXINIC ANALOGUES OF INDOLE-3-ACETIC ACID 1997-10-16 WO disclosed
WO-1997020034-A1 AUXINIC ANALOGUES OF INDOLE-3-ACETIC ACID LIFE TECHNOLOGIES, INC. (US) 1997-06-05 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 (2 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-20030087762-A1 Auxinic analogues of indole-3-acetic acid AADAC, AADAT, AANAT ALDH1A1 938/4885LMNA 4471/4885HTT 1926/4885
US-20050107258-A1 Auxinic analogues of indole-3-acetic acid AADAC, AADAT, AANAT ALDH1A1 1052/4885LMNA 4462/4885HTT 2021/4885

“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.