SCHEMBL2852278

SCHEMBL2852278

CC1CCCCC1(N)CC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.43
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
BLM P54132 1/20 0.40
CACNA2D1 P54289 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2C19 P33261 2/20 0.38
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.32

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
SCHEMBL466184 0.98 CYP1A2 (0.43) CYP1A2USP2ALDH1A1LMNATSHR
Hydrochloric Acid SCHEMBL2858088 0.93 CYP1A2 (0.47) CYP1A2USP2ALDH1A1LMNATSHR
Hydrochloric Acid SCHEMBL27468730 0.85 CYP1A2 (0.42) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL9537043 0.79 CYP1A2 (0.41) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL420260 0.79 CYP1A2 (0.41) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL9537041 0.79 CYP1A2 (0.41) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL283955 0.78 SLC6A4 (0.33)
SCHEMBL9301362 0.78 CYP1A2 (0.40) CYP1A2USP2ALDH1A1LMNATSHR
Water SCHEMBL10639693 0.78 CYP1A2 (0.40) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL11143116 0.78 CYP1A2 (0.40) CYP1A2USP2ALDH1A1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102066416-A Peptides, peptidomimetics and derivatives thereof, the manufacturing thereof as well as their use for preparing a therapeutically and/or preventively active pharmaceutical composition FIBREX MEDICAL RES & DEV GMBH 2011-05-18 CN claimed
CN-102066416-A Peptides, peptidomimetics and derivatives thereof, the manufacturing thereof as well as their use for preparing a therapeutically and/or preventively active pharmaceutical composition FIBREX MEDICAL RES & DEV GMBH 2011-05-18 CN disclosed
WO-2010023694-A2 CRYSTALLINE FORMS OF GABAPENTIN AND PROCESS THEREOF HIKAL LTD (IN) 2010-03-04 WO disclosed
CN-101631768-A Novel prodrugs SUN PHARMA ADVANCED RES CO LTD 2010-01-20 CN disclosed
EP-1603863-B1 PROCESS FOR THE PREPARATION OF AMINO METHYL CYCLO ALKANE ACETIC ACIDS HIKAL LTD (IN) 2010-01-13 EP disclosed
EP-1603863-B1 PROCESS FOR THE PREPARATION OF AMINO METHYL CYCLO ALKANE ACETIC ACIDS HIKAL LTD (IN) 2010-01-13 EP disclosed
US-7635717-B2 Process for the preparation of amino methyl cyclo alkane acetic acids HIKAL LIMITED (IN) 2009-12-22 US disclosed
US-7635717-B2 Process for the preparation of amino methyl cyclo alkane acetic acids HIKAL LIMITED (IN) 2009-12-22 US disclosed
US-20060149099-A1 Process for the preparation of amino methyl cyclo alkane acetic acids HIKAL LIMITED 2006-07-06 US disclosed
US-20060149099-A1 Process for the preparation of amino methyl cyclo alkane acetic acids HIKAL LIMITED 2006-07-06 US disclosed
EP-1603863-A1 PROCESS FOR THE PREPARATION OF AMINO METHYL CYCLO ALKANE ACETIC ACIDS Hikal Ltd. (IN) 2005-12-14 EP disclosed
EP-1603863-A1 PROCESS FOR THE PREPARATION OF AMINO METHYL CYCLO ALKANE ACETIC ACIDS Hikal Ltd. (IN) 2005-12-14 EP disclosed
CN-1626069-A Branched chain amino acid-dependent aminotransferase inhibitors and their use in the treatment of diabetic retinopathy WARNER LAMBERT CO (US) 2005-06-15 CN disclosed
WO-2004046085-A1 PROCESS FOR THE PREPARATION OF AMINO METHYL CYCLO ALKANE ACETIC ACIDS HIKAL LTD. (IN) 2004-06-03 WO disclosed
WO-2004046085-A1 PROCESS FOR THE PREPARATION OF AMINO METHYL CYCLO ALKANE ACETIC ACIDS HIKAL LTD. (IN) 2004-06-03 WO disclosed
CN-1321083-A Method for making coated gabapentine or pregabaline particles LAB PROGRAPHARM (FR) 2001-11-07 CN disclosed
US-4087544-A Treatment of cranial dysfunctions using novel cyclic amino acids WARNER-LAMBERT COMPANY (US) 1978-05-02 US disclosed
US-4024175-A Cyclic amino acids WARNER-LAMBERT COMPANY (US) 1977-05-17 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-20060149099-A1 Process for the preparation of amino methyl cyclo alkane acetic acids GABRA1, GABRA6, ACMSD CYP1A2 499/4885USP2 1057/4885ALDH1A1 366/4885

“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.