SCHEMBL1980752

SCHEMBL1980752

Cc1ccc(-c2nc(C(C)C(=O)O)c(C)o2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 2/20 0.49
IKBKB O14920 2/20 0.47
TP53 P04637 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MAOA P21397 1/20 0.43
ADRA1A P35348 1/20 0.43
HPGD P15428 4/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
THRB P10828 2/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.41
POLB P06746 2/20 0.40
NFKB1 P19838 1/20 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
SCHEMBL10480750 0.83 KDM4E (0.48) TARBP2SMN1; SMN2MAOAADRA1AHPGD
SCHEMBL31539171 0.81 TARBP2 (0.47) TARBP2IKBKBTP53SMN1; SMN2HPGD
SCHEMBL4024618 0.79 AKR1C3 (0.47) IKBKBTP53SMN1; SMN2HPGDNPC1
SCHEMBL504890 0.77 ALDH1A1 (0.45) TP53SMN1; SMN2HPGDNPC1RAB9A
SCHEMBL13721722 0.75 TARBP2 (0.50) TARBP2SMN1; SMN2HPGDRAB9AALDH1A1
SCHEMBL8573767 0.75 GAA (0.51) TARBP2TP53SMN1; SMN2HPGDNPC1
SCHEMBL5216035 0.73 TARBP2 (0.54) TARBP2TP53SMN1; SMN2HPGDNPC1
Hydrochloric Acid SCHEMBL11621803 0.73 TARBP2 (0.64) TARBP2IKBKBTP53SMN1; SMN2HPGD
SCHEMBL7254381 0.71 PTPN1 (0.52) IKBKB
SCHEMBL3886258 0.71 KDM4E (0.50) TARBP2SMN1; SMN2HPGDNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8552203-B2 Indane acetic acid derivatives and their use as pharmaceutical agents, intermediates, and method of preparation BAYER HEALTHCARE LLC (US) 2013-10-08 US disclosed
US-8541618-B2 Indane acetic acid derivatives and their use as pharmaceutical agents, intermediates, and method of preparation BAYER HEALTHCARE LLC (US) 2013-09-24 US disclosed
US-20120141483-A1 METHODS OF TREATING OR PREVENTING PSORIASIS, AND/OR ALZHEIMER'S DISEASE USING INDANE ACETIC ACID DERIVATIVES DARA BIOSCIENCES, INC. 2012-06-07 US disclosed
US-20110152330-A1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION LOWE DEREK B 2011-06-23 US disclosed
US-20110152331-A1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION LOWE DEREK B 2011-06-23 US disclosed
US-20110065129-A1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION LOWE DEREK B 2011-03-17 US disclosed
US-7358386-B2 Indane acetic acid derivatives and their use as pharmaceutical agents, intermediates, and method of preparation BAYER PHARMACEUTICALS CORPORATION (US) 2008-04-15 US disclosed
US-20080026067-A1 Method for Increasing Specific Surface Area of Slightly Soluble Drug ONO PHARMACEUTICAL CO., LTD. (JP) 2008-01-31 US disclosed
US-20060205723-A1 Indane acetic acid derivatives and their use as pharmaceutical agents, intermediates, and method of preparation BAYER PHARMACEUTICALS CORPORATION (US) 2006-09-14 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 (5 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-20110152331-A1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION INSR, ACACA, IAPP TARBP2 4422/4885IKBKB 346/4885TP53 2290/4885
US-20060205723-A1 Indane acetic acid derivatives and their use as pharmaceutical agents, intermediates, and method of preparation INSR, ACACA, IAPP TARBP2 4422/4885IKBKB 346/4885TP53 2290/4885
US-20110152330-A1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION INSR, ACACA, IAPP TARBP2 4422/4885IKBKB 346/4885TP53 2290/4885
US-20110065129-A1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION INSR, ACACA, IAPP TARBP2 4422/4885IKBKB 346/4885TP53 2290/4885
US-20120141483-A1 METHODS OF TREATING OR PREVENTING PSORIASIS, AND/OR ALZHEIMER'S DISEASE USING INDANE ACETIC ACID DERIVATIVES APP, MAPT, TNF TARBP2 4494/4885IKBKB 197/4885TP53 130/4885

“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.